2-[[2-(4-chlorophenyl)-2-[3-(4-chlorophenyl)-7-iodanyl-2,5-bis(oxidanylidene)-1,3-dihydro-1,4-benzodiazepin-4-yl]ethanoyl]amino]-3-methyl-butanoic acid

Systemtic Name: 2-[[2-(4-chlorophenyl)-2-[3-(4-chlorophenyl)-7-iodanyl-2,5-bis(oxidanylidene)-1,3-dihydro-1,4-benzodiazepin-4-yl]ethanoyl]amino]-3-methyl-butanoic acid Openeye Name: 2-[[2-(4-chlorophenyl)-2-[3-(4-chlorophenyl)-7-iodo-2,5-dioxo-1,3-dihydro-1,4-benzodiazepin-4-yl]acetyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[2-(4-chlorophenyl)-2-[3-(4-chlorophenyl)-7-iodo-2,5-dioxo-1,3-dihydro-1,4-benzodiazepin-4-yl]-1-oxoethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-(4-chlorophenyl)-2-[3-(4-chlorophenyl)-7-iodo-2,5-dioxo-1,3-dihydro-1,4-benzodiazepin-4-yl]acetyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-(4-chlorophenyl)-2-[3-(4-chlorophenyl)-7-iodo-2,5-diketo-1,3-dihydro-1,4-benzodiazepin-4-yl]acetyl]amino]-3-methyl-butyric acid Formula: C28H24Cl2IN3O5 MolecularWeight: 680.31773

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H24Cl2IN3O5/c1-14(2)22(28(38)39)33-26(36)24(16-5-9-18(30)10-6-16)34-23(15-3-7-17(29)8-4-15)25(35)32-21-12-11-19(31)13-20(21)27(34)37/h3-14,22-24H,1-2H3,(H,32,35)(H,33,36)(H,38,39)