dimethyl-[(3-oxidanylidene-1,2-dihydroinden-2-yl)oxymethylidene]azanium; 4-methylbenzenesulfonate

Systemtic Name: dimethyl-[(3-oxidanylidene-1,2-dihydroinden-2-yl)oxymethylidene]azanium; 4-methylbenzenesulfonate Openeye Name: dimethyl-[(1-oxoindan-2-yl)oxymethylene]ammonium; 4-methylbenzenesulfonate CAS Name: dimethyl-[(3-oxo-1,2-dihydroinden-2-yl)oxymethylidene]ammonium; 4-methylbenzenesulfonate IUPAC Name: dimethyl-[(3-oxo-1,2-dihydroinden-2-yl)oxymethylidene]azanium; 4-methylbenzenesulfonate Traditional Name: (1-ketoindan-2-yl)oxymethylene-dimethyl-ammonium tosylate Formula: C19H21NO5S MolecularWeight: 375.43874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+](=COC1CC2=CC=CC=C2C1=O)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+](=COC1CC2=CC=CC=C2C1=O)C

InChI

InChI=1S/C12H14NO2.C7H8O3S/c1-13(2)8-15-11-7-9-5-3-4-6-10(9)12(11)14;1-6-2-4-7(5-3-6)11(8,9)10/h3-6,8,11H,7H2,1-2H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1