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Chemistry, part 1

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > amino-acid derivative > amino acid amide > (2r,3r,3as,9bs)-7-(1-cyclopentenyl)-n-[3-(dimethylamino)propyl]-3-(hydroxymethyl)-6-oxo-1-(3,3,3-trifluoropropyl)-3,3a,4,9b-tetrahydro-2h-pyrrolo[2,3-a]indolizine-2-carboxamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > carboxamide > amino acid amide > (2r,3r,3as,9bs)-7-(1-cyclopentenyl)-n-[3-(dimethylamino)propyl]-3-(hydroxymethyl)-6-oxo-1-(3,3,3-trifluoropropyl)-3,3a,4,9b-tetrahydro-2h-pyrrolo[2,3-a]indolizine-2-carboxamide
organooxygen compound > carboxamide > amino acid amide > (2r,3r,3as,9bs)-7-(1-cyclopentenyl)-n-[3-(dimethylamino)propyl]-3-(hydroxymethyl)-6-oxo-1-(3,3,3-trifluoropropyl)-3,3a,4,9b-tetrahydro-2h-pyrrolo[2,3-a]indolizine-2-carboxamide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > amino acid amide > (2r,3r,3as,9bs)-7-(1-cyclopentenyl)-n-[3-(dimethylamino)propyl]-3-(hydroxymethyl)-6-oxo-1-(3,3,3-trifluoropropyl)-3,3a,4,9b-tetrahydro-2h-pyrrolo[2,3-a]indolizine-2-carboxamide

Preferred term

(2r,3r,3as,9bs)-7-(1-cyclopentenyl)-n-[3-(dimethylamino)propyl]-3-(hydroxymethyl)-6-oxo-1-(3,3,3-trifluoropropyl)-3,3a,4,9b-tetrahydro-2h-pyrrolo[2,3-a]indolizine-2-carboxamide  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C25H35F3N4O3

inchi

  • InChI=1S/C25H35F3N4O3/c1-30(2)12-5-11-29-23(34)22-19(15-33)18-14-32-20(21(18)31(22)13-10-25(26,27)28)9-8-17(24(32)35)16-6-3-4-7-16/h6,8-9,18-19,21-22,33H,3-5,7,10-15H2,1-2H3,(H,29,34)/t18-,19-,21+,22-/m1/s1

inchikey

  • VFQPYNAQKZTJPV-KRXUUXHPSA-N

mass

  • 496.567

monoisotopicmass

  • 496.26613

smiles

  • CN(C)CCCNC(=O)[C@H]1[C@@H]([C@H]2CN3C(=CC=C(C3=O)C4=CCCC4)[C@H]2N1CCC(F)(F)F)CO

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:100564

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