[2-(2-methoxyphenyl)-2-oxidanylidene-ethoxy]methylidene-dimethyl-azanium; 4-methylbenzenesulfonate

Systemtic Name: [2-(2-methoxyphenyl)-2-oxidanylidene-ethoxy]methylidene-dimethyl-azanium; 4-methylbenzenesulfonate Openeye Name: [2-(2-methoxyphenyl)-2-oxo-ethoxy]methylene-dimethyl-ammonium; 4-methylbenzenesulfonate CAS Name: [2-(2-methoxyphenyl)-2-oxoethoxy]methylidene-dimethylammonium; 4-methylbenzenesulfonate IUPAC Name: [2-(2-methoxyphenyl)-2-oxoethoxy]methylidene-dimethylazanium; 4-methylbenzenesulfonate Traditional Name: [2-keto-2-(2-methoxyphenyl)ethoxy]methylene-dimethyl-ammonium tosylate Formula: C19H23NO6S MolecularWeight: 393.45402

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+](=COCC(=O)C1=CC=CC=C1OC)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+](=COCC(=O)C1=CC=CC=C1OC)C

InChI

InChI=1S/C12H16NO3.C7H8O3S/c1-13(2)9-16-8-11(14)10-6-4-5-7-12(10)15-3;1-6-2-4-7(5-3-6)11(8,9)10/h4-7,9H,8H2,1-3H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1