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

Systemtic Name: methyl 2-[4-methyl-3-oxidanylidene-7-(4-phenylpiperazin-1-yl)carbonyl-2,5-dihydro-1H-1,4-benzodiazepin-2-yl]ethanoate Openeye Name: methyl 2-[4-methyl-3-oxo-7-(4-phenylpiperazine-1-carbonyl)-2,5-dihydro-1H-1,4-benzodiazepin-2-yl]acetate CAS Name: 2-[4-methyl-3-oxo-7-[oxo-(4-phenyl-1-piperazinyl)methyl]-2,5-dihydro-1H-1,4-benzodiazepin-2-yl]acetic acid methyl ester IUPAC Name: methyl 2-[4-methyl-3-oxo-7-(4-phenylpiperazine-1-carbonyl)-2,5-dihydro-1H-1,4-benzodiazepin-2-yl]acetate Traditional Name: 2-[3-keto-4-methyl-7-(4-phenylpiperazine-1-carbonyl)-2,5-dihydro-1H-1,4-benzodiazepin-2-yl]acetic acid methyl ester Formula: C24H28N4O4 MolecularWeight: 436.50352

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC2=C(C=CC(=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4)NC(C1=O)CC(=O)OC

Isomeric SMILES

CN1CC2=C(C=CC(=C2)C(=O)N3CCN(CC3)C4=CC=CC=C4)NC(C1=O)CC(=O)OC

InChI

InChI=1S/C24H28N4O4/c1-26-16-18-14-17(8-9-20(18)25-21(24(26)31)15-22(29)32-2)23(30)28-12-10-27(11-13-28)19-6-4-3-5-7-19/h3-9,14,21,25H,10-13,15-16H2,1-2H3