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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > benzodiazepine > 2-ethyl-4-[[(3-methyl-2-benzofuranyl)-oxomethyl]amino]-1h-1,5-benzodiazepine-3-carboxylic acid ethyl ester
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organonitrogen heterocyclic compound > benzodiazepine > 2-ethyl-4-[[(3-methyl-2-benzofuranyl)-oxomethyl]amino]-1h-1,5-benzodiazepine-3-carboxylic acid ethyl ester
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > benzodiazepine > 2-ethyl-4-[[(3-methyl-2-benzofuranyl)-oxomethyl]amino]-1h-1,5-benzodiazepine-3-carboxylic acid ethyl ester
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > benzodiazepine > 2-ethyl-4-[[(3-methyl-2-benzofuranyl)-oxomethyl]amino]-1h-1,5-benzodiazepine-3-carboxylic acid ethyl ester

Preferred term

2-ethyl-4-[[(3-methyl-2-benzofuranyl)-oxomethyl]amino]-1h-1,5-benzodiazepine-3-carboxylic acid ethyl ester  

Type

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

Broader concept

charge

  • 0

formula

  • C24H23N3O4

inchi

  • InChI=1S/C24H23N3O4/c1-4-16-20(24(29)30-5-2)22(26-18-12-8-7-11-17(18)25-16)27-23(28)21-14(3)15-10-6-9-13-19(15)31-21/h6-13,25H,4-5H2,1-3H3,(H,26,27,28)

inchikey

  • VVSBIGAAVCDIIT-UHFFFAOYSA-N

mass

  • 417.458

monoisotopicmass

  • 417.16886

smiles

  • CCC1=C(C(=NC2=CC=CC=C2N1)NC(=O)C3=C(C4=CC=CC=C4O3)C)C(=O)OCC

subset

  • 2_STAR

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:116163

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