3-(4-methylphenyl)-3-oxidanyl-4-oxidanylidene-4-phenyl-butane-1-sulfonate

Systemtic Name: 3-(4-methylphenyl)-3-oxidanyl-4-oxidanylidene-4-phenyl-butane-1-sulfonate Openeye Name: 3-hydroxy-4-oxo-4-phenyl-3-(p-tolyl)butane-1-sulfonate CAS Name: 3-hydroxy-3-(4-methylphenyl)-4-oxo-4-phenyl-1-butanesulfonate IUPAC Name: 3-hydroxy-3-(4-methylphenyl)-4-oxo-4-phenylbutane-1-sulfonate Traditional Name: 3-hydroxy-4-keto-4-phenyl-3-(p-tolyl)butane-1-sulfonate Formula: C17H17O5S- MolecularWeight: 333.37888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(CCS(=O)(=O)[O-])(C(=O)C2=CC=CC=C2)O

Isomeric SMILES

CC1=CC=C(C=C1)C(CCS(=O)(=O)[O-])(C(=O)C2=CC=CC=C2)O

InChI

InChI=1S/C17H18O5S/c1-13-7-9-15(10-8-13)17(19,11-12-23(20,21)22)16(18)14-5-3-2-4-6-14/h2-10,19H,11-12H2,1H3,(H,20,21,22)/p-1