[2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 2-chloranyl-5-[(4-fluorophenyl)-methyl-sulfamoyl]benzoate

Systemtic Name: [2-(butan-2-ylamino)-2-oxidanylidene-ethyl] 2-chloranyl-5-[(4-fluorophenyl)-methyl-sulfamoyl]benzoate Openeye Name: [2-oxo-2-(sec-butylamino)ethyl] 2-chloro-5-[(4-fluorophenyl)-methyl-sulfamoyl]benzoate CAS Name: 2-chloro-5-[(4-fluorophenyl)-methylsulfamoyl]benzoic acid [2-(butan-2-ylamino)-2-oxoethyl] ester IUPAC Name: [2-(butan-2-ylamino)-2-oxoethyl] 2-chloro-5-[(4-fluorophenyl)-methylsulfamoyl]benzoate Traditional Name: 2-chloro-5-[(4-fluorophenyl)-methyl-sulfamoyl]benzoic acid [2-keto-2-(sec-butylamino)ethyl] ester Formula: C20H22ClFN2O5S MolecularWeight: 456.915483

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)F)Cl

Isomeric SMILES

CCC(C)NC(=O)COC(=O)C1=C(C=CC(=C1)S(=O)(=O)N(C)C2=CC=C(C=C2)F)Cl

InChI

InChI=1S/C20H22ClFN2O5S/c1-4-13(2)23-19(25)12-29-20(26)17-11-16(9-10-18(17)21)30(27,28)24(3)15-7-5-14(22)6-8-15/h5-11,13H,4,12H2,1-3H3,(H,23,25)