ethyl 2-[5-(4-aminophenyl)carbonyl-7-methyl-2-oxidanylidene-3,4-dihydro-1,5-benzodiazepin-1-yl]ethanoate

Systemtic Name: ethyl 2-[5-(4-aminophenyl)carbonyl-7-methyl-2-oxidanylidene-3,4-dihydro-1,5-benzodiazepin-1-yl]ethanoate Openeye Name: ethyl 2-[5-(4-aminobenzoyl)-7-methyl-2-oxo-3,4-dihydro-1,5-benzodiazepin-1-yl]acetate CAS Name: 2-[5-[(4-aminophenyl)-oxomethyl]-7-methyl-2-oxo-3,4-dihydro-1,5-benzodiazepin-1-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[5-(4-aminobenzoyl)-7-methyl-2-oxo-3,4-dihydro-1,5-benzodiazepin-1-yl]acetate Traditional Name: 2-[5-(4-aminobenzoyl)-2-keto-7-methyl-3,4-dihydro-1,5-benzodiazepin-1-yl]acetic acid ethyl ester Formula: C21H23N3O4 MolecularWeight: 381.42502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C(=O)CCN(C2=C1C=CC(=C2)C)C(=O)C3=CC=C(C=C3)N

Isomeric SMILES

CCOC(=O)CN1C(=O)CCN(C2=C1C=CC(=C2)C)C(=O)C3=CC=C(C=C3)N

InChI

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