1-(3,4-dimethylphenyl)-2-oxidanyl-2-phenyl-ethanone; methanesulfonate

Systemtic Name: 1-(3,4-dimethylphenyl)-2-oxidanyl-2-phenyl-ethanone; methanesulfonate Openeye Name: 1-(3,4-dimethylphenyl)-2-hydroxy-2-phenyl-ethanone; methanesulfonate CAS Name: 1-(3,4-dimethylphenyl)-2-hydroxy-2-phenylethanone; methanesulfonate IUPAC Name: 1-(3,4-dimethylphenyl)-2-hydroxy-2-phenylethanone; methanesulfonate Traditional Name: 1-(3,4-dimethylphenyl)-2-hydroxy-2-phenyl-ethanone mesylate Formula: C17H19O5S- MolecularWeight: 335.39476

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16O2.CH4O3S/c1-11-8-9-14(10-12(11)2)16(18)15(17)13-6-4-3-5-7-13;1-5(2,3)4/h3-10,15,17H,1-2H3;1H3,(H,2,3,4)/p-1