ethyl 2-chloranyl-4-(2-chlorophenyl)carbonyl-5-[2-methylsulfonyloxybutanoyl-(phenylmethyl)amino]benzoate

Systemtic Name: ethyl 2-chloranyl-4-(2-chlorophenyl)carbonyl-5-[2-methylsulfonyloxybutanoyl-(phenylmethyl)amino]benzoate Openeye Name: ethyl 5-[benzyl(2-methylsulfonyloxybutanoyl)amino]-2-chloro-4-(2-chlorobenzoyl)benzoate CAS Name: 2-chloro-4-[(2-chlorophenyl)-oxomethyl]-5-[(2-methylsulfonyloxy-1-oxobutyl)-(phenylmethyl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 5-[benzyl(2-methylsulfonyloxybutanoyl)amino]-2-chloro-4-(2-chlorobenzoyl)benzoate Traditional Name: 5-[benzyl(2-methylsulfonyloxybutanoyl)amino]-2-chloro-4-(2-chlorobenzoyl)benzoic acid ethyl ester Formula: C28H27Cl2NO7S MolecularWeight: 592.48748

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N(CC1=CC=CC=C1)C2=C(C=C(C(=C2)C(=O)OCC)Cl)C(=O)C3=CC=CC=C3Cl)OS(=O)(=O)C

Isomeric SMILES

CCC(C(=O)N(CC1=CC=CC=C1)C2=C(C=C(C(=C2)C(=O)OCC)Cl)C(=O)C3=CC=CC=C3Cl)OS(=O)(=O)C

InChI

InChI=1S/C28H27Cl2NO7S/c1-4-25(38-39(3,35)36)27(33)31(17-18-11-7-6-8-12-18)24-16-20(28(34)37-5-2)23(30)15-21(24)26(32)19-13-9-10-14-22(19)29/h6-16,25H,4-5,17H2,1-3H3