[2,2-dimethyl-3-[(4-methylphenyl)amino]-3-oxidanylidene-1-phenyl-propyl] benzenesulfonate

Systemtic Name: [2,2-dimethyl-3-[(4-methylphenyl)amino]-3-oxidanylidene-1-phenyl-propyl] benzenesulfonate Openeye Name: [2,2-dimethyl-3-(4-methylanilino)-3-oxo-1-phenyl-propyl] benzenesulfonate CAS Name: benzenesulfonic acid [2,2-dimethyl-3-(4-methylanilino)-3-oxo-1-phenylpropyl] ester IUPAC Name: [2,2-dimethyl-3-(4-methylanilino)-3-oxo-1-phenylpropyl] benzenesulfonate Traditional Name: benzenesulfonic acid [3-keto-2,2-dimethyl-1-phenyl-3-(p-toluidino)propyl] ester Formula: C24H25NO4S MolecularWeight: 423.5246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C(C)(C)C(C2=CC=CC=C2)OS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C(C)(C)C(C2=CC=CC=C2)OS(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C24H25NO4S/c1-18-14-16-20(17-15-18)25-23(26)24(2,3)22(19-10-6-4-7-11-19)29-30(27,28)21-12-8-5-9-13-21/h4-17,22H,1-3H3,(H,25,26)