[2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 2-[(4-fluoranyl-2-methyl-phenyl)sulfonylamino]benzoate

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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