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

Systemtic Name: 2-[7-acetamido-3-(4-chlorophenyl)-2,5-bis(oxidanylidene)-1,3-dihydro-1,4-benzodiazepin-4-yl]-2-phenyl-ethanoic acid Openeye Name: 2-[7-acetamido-3-(4-chlorophenyl)-2,5-dioxo-1,3-dihydro-1,4-benzodiazepin-4-yl]-2-phenyl-acetic acid CAS Name: 2-[7-acetamido-3-(4-chlorophenyl)-2,5-dioxo-1,3-dihydro-1,4-benzodiazepin-4-yl]-2-phenylacetic acid IUPAC Name: 2-[7-acetamido-3-(4-chlorophenyl)-2,5-dioxo-1,3-dihydro-1,4-benzodiazepin-4-yl]-2-phenylacetic acid Traditional Name: 2-[7-acetamido-3-(4-chlorophenyl)-2,5-diketo-1,3-dihydro-1,4-benzodiazepin-4-yl]-2-phenyl-acetic acid Formula: C25H20ClN3O5 MolecularWeight: 477.8964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=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

CC(=O)NC1=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/C25H20ClN3O5/c1-14(30)27-18-11-12-20-19(13-18)24(32)29(22(25(33)34)15-5-3-2-4-6-15)21(23(31)28-20)16-7-9-17(26)10-8-16/h2-13,21-22H,1H3,(H,27,30)(H,28,31)(H,33,34)