(4-methanoylphenyl)-trimethyl-azanium; 4-methylbenzenesulfonate

Systemtic Name: (4-methanoylphenyl)-trimethyl-azanium; 4-methylbenzenesulfonate Openeye Name: (4-formylphenyl)-trimethyl-ammonium; 4-methylbenzenesulfonate CAS Name: (4-formylphenyl)-trimethylammonium; 4-methylbenzenesulfonate IUPAC Name: (4-formylphenyl)-trimethylazanium; 4-methylbenzenesulfonate Traditional Name: (4-formylphenyl)-trimethyl-ammonium tosylate Formula: C17H21NO4S MolecularWeight: 335.41794

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H14NO.C7H8O3S/c1-11(2,3)10-6-4-9(8-12)5-7-10;1-6-2-4-7(5-3-6)11(8,9)10/h4-8H,1-3H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1