dimethyl(propyl)azanium; 4-methylbenzenesulfonate

Systemtic Name: dimethyl(propyl)azanium; 4-methylbenzenesulfonate Openeye Name: dimethyl(propyl)ammonium; 4-methylbenzenesulfonate CAS Name: dimethyl(propyl)ammonium; 4-methylbenzenesulfonate IUPAC Name: dimethyl(propyl)azanium; 4-methylbenzenesulfonate Traditional Name: dimethyl(propyl)ammonium tosylate Formula: C12H21NO3S MolecularWeight: 259.36504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H8O3S.C5H13N/c1-6-2-4-7(5-3-6)11(8,9)10;1-4-5-6(2)3/h2-5H,1H3,(H,8,9,10);4-5H2,1-3H3