ethyl 2-ethyl-4-[2-(4-methoxyphenyl)ethanoylamino]-1H-1,5-benzodiazepine-3-carboxylate

Systemtic Name: ethyl 2-ethyl-4-[2-(4-methoxyphenyl)ethanoylamino]-1H-1,5-benzodiazepine-3-carboxylate Openeye Name: ethyl 2-ethyl-4-[[2-(4-methoxyphenyl)acetyl]amino]-1H-1,5-benzodiazepine-3-carboxylate CAS Name: 2-ethyl-4-[[2-(4-methoxyphenyl)-1-oxoethyl]amino]-1H-1,5-benzodiazepine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-ethyl-4-[[2-(4-methoxyphenyl)acetyl]amino]-1H-1,5-benzodiazepine-3-carboxylate Traditional Name: 2-ethyl-4-[[2-(4-methoxyphenyl)acetyl]amino]-1H-1,5-benzodiazepine-3-carboxylic acid ethyl ester Formula: C23H25N3O4 MolecularWeight: 407.4623

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC2=CC=CC=C2N1)NC(=O)CC3=CC=C(C=C3)OC)C(=O)OCC

Isomeric SMILES

CCC1=C(C(=NC2=CC=CC=C2N1)NC(=O)CC3=CC=C(C=C3)OC)C(=O)OCC

InChI

InChI=1S/C23H25N3O4/c1-4-17-21(23(28)30-5-2)22(25-19-9-7-6-8-18(19)24-17)26-20(27)14-15-10-12-16(29-3)13-11-15/h6-13,24H,4-5,14H2,1-3H3,(H,25,26,27)