dimethyl-[(1-oxidanylidene-1-phenyl-propan-2-yl)oxymethylidene]azanium; 4-methylbenzenesulfonate

Systemtic Name: dimethyl-[(1-oxidanylidene-1-phenyl-propan-2-yl)oxymethylidene]azanium; 4-methylbenzenesulfonate Openeye Name: dimethyl-[(1-methyl-2-oxo-2-phenyl-ethoxy)methylene]ammonium; 4-methylbenzenesulfonate CAS Name: dimethyl-[(1-oxo-1-phenylpropan-2-yl)oxymethylidene]ammonium; 4-methylbenzenesulfonate IUPAC Name: dimethyl-[(1-oxo-1-phenylpropan-2-yl)oxymethylidene]azanium; 4-methylbenzenesulfonate Traditional Name: (2-keto-1-methyl-2-phenyl-ethoxy)methylene-dimethyl-ammonium tosylate Formula: C19H23NO5S MolecularWeight: 377.45462

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].CC(C(=O)C1=CC=CC=C1)OC=[N+](C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].CC(C(=O)C1=CC=CC=C1)OC=[N+](C)C

InChI

InChI=1S/C12H16NO2.C7H8O3S/c1-10(15-9-13(2)3)12(14)11-7-5-4-6-8-11;1-6-2-4-7(5-3-6)11(8,9)10/h4-10H,1-3H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1