(phenylmethyl) 4-[3-acetamido-5-chloranyl-3-(2-chlorophenyl)-2-oxidanylidene-indol-1-yl]sulfonyl-3-methoxy-benzoate

Systemtic Name: (phenylmethyl) 4-[3-acetamido-5-chloranyl-3-(2-chlorophenyl)-2-oxidanylidene-indol-1-yl]sulfonyl-3-methoxy-benzoate Openeye Name: benzyl 4-[3-acetamido-5-chloro-3-(2-chlorophenyl)-2-oxo-indolin-1-yl]sulfonyl-3-methoxy-benzoate CAS Name: 4-[[3-acetamido-5-chloro-3-(2-chlorophenyl)-2-oxo-1-indolyl]sulfonyl]-3-methoxybenzoic acid (phenylmethyl) ester IUPAC Name: benzyl 4-[3-acetamido-5-chloro-3-(2-chlorophenyl)-2-oxoindol-1-yl]sulfonyl-3-methoxybenzoate Traditional Name: 4-[3-acetamido-5-chloro-3-(2-chlorophenyl)-2-keto-indolin-1-yl]sulfonyl-3-methoxy-benzoic acid benzyl ester Formula: C31H24Cl2N2O7S MolecularWeight: 639.50246

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1(C2=C(C=CC(=C2)Cl)N(C1=O)S(=O)(=O)C3=C(C=C(C=C3)C(=O)OCC4=CC=CC=C4)OC)C5=CC=CC=C5Cl

Isomeric SMILES

CC(=O)NC1(C2=C(C=CC(=C2)Cl)N(C1=O)S(=O)(=O)C3=C(C=C(C=C3)C(=O)OCC4=CC=CC=C4)OC)C5=CC=CC=C5Cl

InChI

InChI=1S/C31H24Cl2N2O7S/c1-19(36)34-31(23-10-6-7-11-25(23)33)24-17-22(32)13-14-26(24)35(30(31)38)43(39,40)28-15-12-21(16-27(28)41-2)29(37)42-18-20-8-4-3-5-9-20/h3-17H,18H2,1-2H3,(H,34,36)