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

Systemtic Name: 2-[7-bromanyl-3-(4-chlorophenyl)-2,5-bis(oxidanylidene)-1,3-dihydro-1,4-benzodiazepin-4-yl]-3-phenyl-propanoic acid Openeye Name: 2-[7-bromo-3-(4-chlorophenyl)-2,5-dioxo-1,3-dihydro-1,4-benzodiazepin-4-yl]-3-phenyl-propanoic acid CAS Name: 2-[7-bromo-3-(4-chlorophenyl)-2,5-dioxo-1,3-dihydro-1,4-benzodiazepin-4-yl]-3-phenylpropanoic acid IUPAC Name: 2-[7-bromo-3-(4-chlorophenyl)-2,5-dioxo-1,3-dihydro-1,4-benzodiazepin-4-yl]-3-phenylpropanoic acid Traditional Name: 2-[7-bromo-3-(4-chlorophenyl)-2,5-diketo-1,3-dihydro-1,4-benzodiazepin-4-yl]-3-phenyl-propionic acid Formula: C24H18BrClN2O4 MolecularWeight: 513.76772

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)N2C(C(=O)NC3=C(C2=O)C=C(C=C3)Br)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)N2C(C(=O)NC3=C(C2=O)C=C(C=C3)Br)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H18BrClN2O4/c25-16-8-11-19-18(13-16)23(30)28(20(24(31)32)12-14-4-2-1-3-5-14)21(22(29)27-19)15-6-9-17(26)10-7-15/h1-11,13,20-21H,12H2,(H,27,29)(H,31,32)