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

Systemtic Name: 2-[3-(4-chlorophenyl)-7-iodanyl-2,5-bis(oxidanylidene)-1,3-dihydro-1,4-benzodiazepin-4-yl]-3-naphthalen-2-yl-propanoic acid Openeye Name: 2-[3-(4-chlorophenyl)-7-iodo-2,5-dioxo-1,3-dihydro-1,4-benzodiazepin-4-yl]-3-(2-naphthyl)propanoic acid CAS Name: 2-[3-(4-chlorophenyl)-7-iodo-2,5-dioxo-1,3-dihydro-1,4-benzodiazepin-4-yl]-3-(2-naphthalenyl)propanoic acid IUPAC Name: 2-[3-(4-chlorophenyl)-7-iodo-2,5-dioxo-1,3-dihydro-1,4-benzodiazepin-4-yl]-3-naphthalen-2-ylpropanoic acid Traditional Name: 2-[3-(4-chlorophenyl)-7-iodo-2,5-diketo-1,3-dihydro-1,4-benzodiazepin-4-yl]-3-(2-naphthyl)propionic acid Formula: C28H20ClIN2O4 MolecularWeight: 610.82687

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=C(C=CC2=C1)CC(C(=O)O)N3C(C(=O)NC4=C(C3=O)C=C(C=C4)I)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1=CC=C2C=C(C=CC2=C1)CC(C(=O)O)N3C(C(=O)NC4=C(C3=O)C=C(C=C4)I)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C28H20ClIN2O4/c29-20-9-7-18(8-10-20)25-26(33)31-23-12-11-21(30)15-22(23)27(34)32(25)24(28(35)36)14-16-5-6-17-3-1-2-4-19(17)13-16/h1-13,15,24-25H,14H2,(H,31,33)(H,35,36)