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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 > carbon group molecular entity > organic molecular entity > organic amino compound > tertiary amino compound > (2s,3s)-2-[[cyclohexylmethyl(methyl)amino]methyl]-8-(dimethylamino)-5-[(2s)-1-hydroxypropan-2-yl]-3-methyl-3,4-dihydro-2h-1,5-benzoxazocin-6-one
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > tertiary amino compound > (2s,3s)-2-[[cyclohexylmethyl(methyl)amino]methyl]-8-(dimethylamino)-5-[(2s)-1-hydroxypropan-2-yl]-3-methyl-3,4-dihydro-2h-1,5-benzoxazocin-6-one
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic amino compound > amine > alkylamines > dialkylarylamine > (2s,3s)-2-[[cyclohexylmethyl(methyl)amino]methyl]-8-(dimethylamino)-5-[(2s)-1-hydroxypropan-2-yl]-3-methyl-3,4-dihydro-2h-1,5-benzoxazocin-6-one
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > organonitrogen compound > organic amino compound > amine > alkylamines > dialkylarylamine > (2s,3s)-2-[[cyclohexylmethyl(methyl)amino]methyl]-8-(dimethylamino)-5-[(2s)-1-hydroxypropan-2-yl]-3-methyl-3,4-dihydro-2h-1,5-benzoxazocin-6-one

Preferred term

(2s,3s)-2-[[cyclohexylmethyl(methyl)amino]methyl]-8-(dimethylamino)-5-[(2s)-1-hydroxypropan-2-yl]-3-methyl-3,4-dihydro-2h-1,5-benzoxazocin-6-one  

Type

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

Broader concept

charge

  • 0

formula

  • C25H41N3O3

inchi

  • InChI=1S/C25H41N3O3/c1-18-14-28(19(2)17-29)25(30)22-13-21(26(3)4)11-12-23(22)31-24(18)16-27(5)15-20-9-7-6-8-10-20/h11-13,18-20,24,29H,6-10,14-17H2,1-5H3/t18-,19-,24+/m0/s1

inchikey

  • ISZUZFSFVMPJQK-AXHZCLLHSA-N

mass

  • 431.612

monoisotopicmass

  • 431.31479

smiles

  • C[C@H]1CN(C(=O)C2=C(C=CC(=C2)N(C)C)O[C@@H]1CN(C)CC3CCCCC3)[C@@H](C)CO

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:111583

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