methyl 2-[[4-[(2-chlorophenyl)carbonylamino]-3-fluoranyl-phenyl]sulfonylamino]benzoate

Systemtic Name: methyl 2-[[4-[(2-chlorophenyl)carbonylamino]-3-fluoranyl-phenyl]sulfonylamino]benzoate Openeye Name: methyl 2-[[4-[(2-chlorobenzoyl)amino]-3-fluoro-phenyl]sulfonylamino]benzoate CAS Name: 2-[[4-[[(2-chlorophenyl)-oxomethyl]amino]-3-fluorophenyl]sulfonylamino]benzoic acid methyl ester IUPAC Name: methyl 2-[[4-[(2-chlorobenzoyl)amino]-3-fluorophenyl]sulfonylamino]benzoate Traditional Name: 2-[[4-[(2-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=CC=C1NS(=O)(=O)C2=CC(=C(C=C2)NC(=O)C3=CC=CC=C3Cl)F

Isomeric SMILES

COC(=O)C1=CC=CC=C1NS(=O)(=O)C2=CC(=C(C=C2)NC(=O)C3=CC=CC=C3Cl)F

InChI

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