dimethyl-[(2-naphthalen-1-yl-2-oxidanylidene-ethoxy)methylidene]azanium; 4-methylbenzenesulfonate

Systemtic Name: dimethyl-[(2-naphthalen-1-yl-2-oxidanylidene-ethoxy)methylidene]azanium; 4-methylbenzenesulfonate Openeye Name: dimethyl-[[2-(1-naphthyl)-2-oxo-ethoxy]methylene]ammonium; 4-methylbenzenesulfonate CAS Name: dimethyl-[[2-(1-naphthalenyl)-2-oxoethoxy]methylidene]ammonium; 4-methylbenzenesulfonate IUPAC Name: dimethyl-[(2-naphthalen-1-yl-2-oxoethoxy)methylidene]azanium; 4-methylbenzenesulfonate Traditional Name: [2-keto-2-(1-naphthyl)ethoxy]methylene-dimethyl-ammonium tosylate Formula: C22H23NO5S MolecularWeight: 413.48672

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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=CC2=CC=CC=C21)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+](=COCC(=O)C1=CC=CC2=CC=CC=C21)C

InChI

InChI=1S/C15H16NO2.C7H8O3S/c1-16(2)11-18-10-15(17)14-9-5-7-12-6-3-4-8-13(12)14;1-6-2-4-7(5-3-6)11(8,9)10/h3-9,11H,10H2,1-2H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1