[(2S)-1-(4-tert-butylphenyl)-1-oxidanylidene-propan-2-yl] 3-[methyl-(4-methylphenyl)sulfamoyl]benzoate

Systemtic Name: [(2S)-1-(4-tert-butylphenyl)-1-oxidanylidene-propan-2-yl] 3-[methyl-(4-methylphenyl)sulfamoyl]benzoate Openeye Name: [(1S)-2-(4-tert-butylphenyl)-1-methyl-2-oxo-ethyl] 3-[methyl(p-tolyl)sulfamoyl]benzoate CAS Name: 3-[methyl-(4-methylphenyl)sulfamoyl]benzoic acid [(2S)-1-(4-tert-butylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(4-tert-butylphenyl)-1-oxopropan-2-yl] 3-[methyl-(4-methylphenyl)sulfamoyl]benzoate Traditional Name: 3-[methyl(p-tolyl)sulfamoyl]benzoic acid [(1S)-2-(4-tert-butylphenyl)-2-keto-1-methyl-ethyl] ester Formula: C28H31NO5S MolecularWeight: 493.61444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(C)S(=O)(=O)C2=CC=CC(=C2)C(=O)OC(C)C(=O)C3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)N(C)S(=O)(=O)C2=CC=CC(=C2)C(=O)O[C@@H](C)C(=O)C3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C28H31NO5S/c1-19-10-16-24(17-11-19)29(6)35(32,33)25-9-7-8-22(18-25)27(31)34-20(2)26(30)21-12-14-23(15-13-21)28(3,4)5/h7-18,20H,1-6H3/t20-/m0/s1