2-[3-(4-chlorophenyl)-7-ethyl-2,5-bis(oxidanylidene)-1,3-dihydro-1,4-benzodiazepin-4-yl]-2-phenyl-ethanoic acid

Systemtic Name: 2-[3-(4-chlorophenyl)-7-ethyl-2,5-bis(oxidanylidene)-1,3-dihydro-1,4-benzodiazepin-4-yl]-2-phenyl-ethanoic acid Openeye Name: 2-[3-(4-chlorophenyl)-7-ethyl-2,5-dioxo-1,3-dihydro-1,4-benzodiazepin-4-yl]-2-phenyl-acetic acid CAS Name: 2-[3-(4-chlorophenyl)-7-ethyl-2,5-dioxo-1,3-dihydro-1,4-benzodiazepin-4-yl]-2-phenylacetic acid IUPAC Name: 2-[3-(4-chlorophenyl)-7-ethyl-2,5-dioxo-1,3-dihydro-1,4-benzodiazepin-4-yl]-2-phenylacetic acid Traditional Name: 2-[3-(4-chlorophenyl)-7-ethyl-2,5-diketo-1,3-dihydro-1,4-benzodiazepin-4-yl]-2-phenyl-acetic acid Formula: C25H21ClN2O4 MolecularWeight: 448.89824

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)NC(=O)C(N(C2=O)C(C3=CC=CC=C3)C(=O)O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCC1=CC2=C(C=C1)NC(=O)C(N(C2=O)C(C3=CC=CC=C3)C(=O)O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H21ClN2O4/c1-2-15-8-13-20-19(14-15)24(30)28(22(25(31)32)16-6-4-3-5-7-16)21(23(29)27-20)17-9-11-18(26)12-10-17/h3-14,21-22H,2H2,1H3,(H,27,29)(H,31,32)