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

Systemtic Name: 2-[3-(4-bromophenyl)-2,5-bis(oxidanylidene)-7-propan-2-yl-1,3-dihydro-1,4-benzodiazepin-4-yl]-2-(4-chlorophenyl)ethanoic acid Openeye Name: 2-[3-(4-bromophenyl)-7-isopropyl-2,5-dioxo-1,3-dihydro-1,4-benzodiazepin-4-yl]-2-(4-chlorophenyl)acetic acid CAS Name: 2-[3-(4-bromophenyl)-2,5-dioxo-7-propan-2-yl-1,3-dihydro-1,4-benzodiazepin-4-yl]-2-(4-chlorophenyl)acetic acid IUPAC Name: 2-[3-(4-bromophenyl)-2,5-dioxo-7-propan-2-yl-1,3-dihydro-1,4-benzodiazepin-4-yl]-2-(4-chlorophenyl)acetic acid Traditional Name: 2-[3-(4-bromophenyl)-7-isopropyl-2,5-diketo-1,3-dihydro-1,4-benzodiazepin-4-yl]-2-(4-chlorophenyl)acetic acid Formula: C26H22BrClN2O4 MolecularWeight: 541.82088

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H22BrClN2O4/c1-14(2)17-7-12-21-20(13-17)25(32)30(23(26(33)34)16-5-10-19(28)11-6-16)22(24(31)29-21)15-3-8-18(27)9-4-15/h3-14,22-23H,1-2H3,(H,29,31)(H,33,34)