ethyl 2-[5-(4-aminophenyl)carbonyl-4-methyl-2-oxidanylidene-3,4-dihydro-1,5-benzodiazepin-1-yl]ethanoate

Systemtic Name: ethyl 2-[5-(4-aminophenyl)carbonyl-4-methyl-2-oxidanylidene-3,4-dihydro-1,5-benzodiazepin-1-yl]ethanoate Openeye Name: ethyl 2-[5-(4-aminobenzoyl)-4-methyl-2-oxo-3,4-dihydro-1,5-benzodiazepin-1-yl]acetate CAS Name: 2-[5-[(4-aminophenyl)-oxomethyl]-4-methyl-2-oxo-3,4-dihydro-1,5-benzodiazepin-1-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[5-(4-aminobenzoyl)-4-methyl-2-oxo-3,4-dihydro-1,5-benzodiazepin-1-yl]acetate Traditional Name: 2-[5-(4-aminobenzoyl)-2-keto-4-methyl-3,4-dihydro-1,5-benzodiazepin-1-yl]acetic acid ethyl ester Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(=O)CC(N(C2=CC=CC=C21)C(=O)C3=CC=C(C=C3)N)C

Isomeric SMILES

CCOC(=O)CN1C(=O)CC(N(C2=CC=CC=C21)C(=O)C3=CC=C(C=C3)N)C

InChI

InChI=1S/C21H23N3O4/c1-3-28-20(26)13-23-17-6-4-5-7-18(17)24(14(2)12-19(23)25)21(27)15-8-10-16(22)11-9-15/h4-11,14H,3,12-13,22H2,1-2H3