[1-(4-ethylphenyl)-1-oxidanylidene-propan-2-yl] 3-[methyl(phenyl)sulfamoyl]benzoate

Systemtic Name: [1-(4-ethylphenyl)-1-oxidanylidene-propan-2-yl] 3-[methyl(phenyl)sulfamoyl]benzoate Openeye Name: [2-(4-ethylphenyl)-1-methyl-2-oxo-ethyl] 3-[methyl(phenyl)sulfamoyl]benzoate CAS Name: 3-[methyl(phenyl)sulfamoyl]benzoic acid [1-(4-ethylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [1-(4-ethylphenyl)-1-oxopropan-2-yl] 3-[methyl(phenyl)sulfamoyl]benzoate Traditional Name: 3-[methyl(phenyl)sulfamoyl]benzoic acid [2-(4-ethylphenyl)-2-keto-1-methyl-ethyl] ester Formula: C25H25NO5S MolecularWeight: 451.5347

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)C(C)OC(=O)C2=CC(=CC=C2)S(=O)(=O)N(C)C3=CC=CC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)C(C)OC(=O)C2=CC(=CC=C2)S(=O)(=O)N(C)C3=CC=CC=C3

InChI

InChI=1S/C25H25NO5S/c1-4-19-13-15-20(16-14-19)24(27)18(2)31-25(28)21-9-8-12-23(17-21)32(29,30)26(3)22-10-6-5-7-11-22/h5-18H,4H2,1-3H3