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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 > carboxamide > tertiary carboxamide > 1-methyl-4-[2-oxo-2-(n-(phenylmethyl)anilino)ethyl]-5-pyrrolo[3,2-b]pyrrolecarboxylic acid propan-2-yl ester
organooxygen compound > carboxamide > tertiary carboxamide > 1-methyl-4-[2-oxo-2-(n-(phenylmethyl)anilino)ethyl]-5-pyrrolo[3,2-b]pyrrolecarboxylic acid propan-2-yl ester
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > pnictogen molecular entity > nitrogen molecular entity > amide > primary amide > carboxamide > tertiary carboxamide > 1-methyl-4-[2-oxo-2-(n-(phenylmethyl)anilino)ethyl]-5-pyrrolo[3,2-b]pyrrolecarboxylic acid propan-2-yl ester
organooxygen compound > ester > carboxylic ester > isopropyl ester > 1-methyl-4-[2-oxo-2-(n-(phenylmethyl)anilino)ethyl]-5-pyrrolo[3,2-b]pyrrolecarboxylic acid propan-2-yl ester
organooxygen compound > carbonyl compound > carboxylic ester > isopropyl ester > 1-methyl-4-[2-oxo-2-(n-(phenylmethyl)anilino)ethyl]-5-pyrrolo[3,2-b]pyrrolecarboxylic acid propan-2-yl ester

Preferred term

1-methyl-4-[2-oxo-2-(n-(phenylmethyl)anilino)ethyl]-5-pyrrolo[3,2-b]pyrrolecarboxylic acid propan-2-yl ester  

Type

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

Broader concept

charge

  • 0

formula

  • C26H27N3O3

inchi

  • InChI=1S/C26H27N3O3/c1-19(2)32-26(31)24-16-23-22(14-15-27(23)3)29(24)18-25(30)28(21-12-8-5-9-13-21)17-20-10-6-4-7-11-20/h4-16,19H,17-18H2,1-3H3

inchikey

  • RRELPZIEZSCVER-UHFFFAOYSA-N

mass

  • 429.512

monoisotopicmass

  • 429.20524

smiles

  • CC(C)OC(=O)C1=CC2=C(N1CC(=O)N(CC3=CC=CC=C3)C4=CC=CC=C4)C=CN2C

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:115641

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