2-[3-[2-(4-chlorophenyl)ethanoylamino]-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl]ethanoic acid

Systemtic Name: 2-[3-[2-(4-chlorophenyl)ethanoylamino]-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl]ethanoic acid Openeye Name: 2-[3-[[2-(4-chlorophenyl)acetyl]amino]-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl]acetic acid CAS Name: 2-[3-[[2-(4-chlorophenyl)-1-oxoethyl]amino]-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl]acetic acid IUPAC Name: 2-[3-[[2-(4-chlorophenyl)acetyl]amino]-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl]acetic acid Traditional Name: 2-[3-[[2-(4-chlorophenyl)acetyl]amino]-2-keto-5-phenyl-3H-1,4-benzodiazepin-1-yl]acetic acid Formula: C25H20ClN3O4 MolecularWeight: 461.897

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(C(=O)N(C3=CC=CC=C32)CC(=O)O)NC(=O)CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(C(=O)N(C3=CC=CC=C32)CC(=O)O)NC(=O)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H20ClN3O4/c26-18-12-10-16(11-13-18)14-21(30)27-24-25(33)29(15-22(31)32)20-9-5-4-8-19(20)23(28-24)17-6-2-1-3-7-17/h1-13,24H,14-15H2,(H,27,30)(H,31,32)