1-oxidanylideneethanesulfonate; trimethyl-(3-methylphenyl)azanium

Systemtic Name: 1-oxidanylideneethanesulfonate; trimethyl-(3-methylphenyl)azanium Openeye Name: 1-oxoethanesulfonate; trimethyl(m-tolyl)ammonium CAS Name: 1-oxoethanesulfonate; trimethyl-(3-methylphenyl)ammonium IUPAC Name: 1-oxoethanesulfonate; trimethyl-(3-methylphenyl)azanium Traditional Name: 1-ketoethanesulfonate; trimethyl(m-tolyl)ammonium Formula: C12H19NO4S MolecularWeight: 273.34856

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H16N.C2H4O4S/c1-9-6-5-7-10(8-9)11(2,3)4;1-2(3)7(4,5)6/h5-8H,1-4H3;1H3,(H,4,5,6)/q+1;/p-1