methyl 4-[[4-[(3-chlorophenyl)carbonylamino]-3-fluoranyl-phenyl]sulfonylamino]benzoate

Systemtic Name: methyl 4-[[4-[(3-chlorophenyl)carbonylamino]-3-fluoranyl-phenyl]sulfonylamino]benzoate Openeye Name: methyl 4-[[4-[(3-chlorobenzoyl)amino]-3-fluoro-phenyl]sulfonylamino]benzoate CAS Name: 4-[[4-[[(3-chlorophenyl)-oxomethyl]amino]-3-fluorophenyl]sulfonylamino]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-[(3-chlorobenzoyl)amino]-3-fluorophenyl]sulfonylamino]benzoate Traditional Name: 4-[[4-[(3-chlorobenzoyl)amino]-3-fluoro-phenyl]sulfonylamino]benzoic acid methyl ester Formula: C21H16ClFN2O5S MolecularWeight: 462.878543

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)NC(=O)C3=CC(=CC=C3)Cl)F

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC(=C(C=C2)NC(=O)C3=CC(=CC=C3)Cl)F

InChI

InChI=1S/C21H16ClFN2O5S/c1-30-21(27)13-5-7-16(8-6-13)25-31(28,29)17-9-10-19(18(23)12-17)24-20(26)14-3-2-4-15(22)11-14/h2-12,25H,1H3,(H,24,26)