[2-[[4-[butyl(methyl)sulfamoyl]phenyl]amino]-2-oxidanylidene-ethyl] 3-methylbenzoate

Systemtic Name: [2-[[4-[butyl(methyl)sulfamoyl]phenyl]amino]-2-oxidanylidene-ethyl] 3-methylbenzoate Openeye Name: [2-[4-[butyl(methyl)sulfamoyl]anilino]-2-oxo-ethyl] 3-methylbenzoate CAS Name: 3-methylbenzoic acid [2-[4-[butyl(methyl)sulfamoyl]anilino]-2-oxoethyl] ester IUPAC Name: [2-[4-[butyl(methyl)sulfamoyl]anilino]-2-oxoethyl] 3-methylbenzoate Traditional Name: 3-methylbenzoic acid [2-[4-[butyl(methyl)sulfamoyl]anilino]-2-keto-ethyl] ester Formula: C21H26N2O5S MolecularWeight: 418.50654

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)S(=O)(=O)C1=CC=C(C=C1)NC(=O)COC(=O)C2=CC(=CC=C2)C

Isomeric SMILES

CCCCN(C)S(=O)(=O)C1=CC=C(C=C1)NC(=O)COC(=O)C2=CC(=CC=C2)C

InChI

InChI=1S/C21H26N2O5S/c1-4-5-13-23(3)29(26,27)19-11-9-18(10-12-19)22-20(24)15-28-21(25)17-8-6-7-16(2)14-17/h6-12,14H,4-5,13,15H2,1-3H3,(H,22,24)