[2-(butylamino)-2-oxidanylidene-ethyl] 2-[(4-fluoranyl-3-methyl-phenyl)sulfonylamino]benzoate

Systemtic Name: [2-(butylamino)-2-oxidanylidene-ethyl] 2-[(4-fluoranyl-3-methyl-phenyl)sulfonylamino]benzoate Openeye Name: [2-(butylamino)-2-oxo-ethyl] 2-[(4-fluoro-3-methyl-phenyl)sulfonylamino]benzoate CAS Name: 2-[(4-fluoro-3-methylphenyl)sulfonylamino]benzoic acid [2-(butylamino)-2-oxoethyl] ester IUPAC Name: [2-(butylamino)-2-oxoethyl] 2-[(4-fluoro-3-methylphenyl)sulfonylamino]benzoate Traditional Name: 2-[(4-fluoro-3-methyl-phenyl)sulfonylamino]benzoic acid [2-(butylamino)-2-keto-ethyl] ester Formula: C20H23FN2O5S MolecularWeight: 422.470423

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)COC(=O)C1=CC=CC=C1NS(=O)(=O)C2=CC(=C(C=C2)F)C

Isomeric SMILES

CCCCNC(=O)COC(=O)C1=CC=CC=C1NS(=O)(=O)C2=CC(=C(C=C2)F)C

InChI

InChI=1S/C20H23FN2O5S/c1-3-4-11-22-19(24)13-28-20(25)16-7-5-6-8-18(16)23-29(26,27)15-9-10-17(21)14(2)12-15/h5-10,12,23H,3-4,11,13H2,1-2H3,(H,22,24)