ethyl-dimethyl-phenyl-azanium; 4-methylbenzenesulfonate

Systemtic Name: ethyl-dimethyl-phenyl-azanium; 4-methylbenzenesulfonate Openeye Name: ethyl-dimethyl-phenyl-ammonium; 4-methylbenzenesulfonate CAS Name: ethyl-dimethyl-phenylammonium; 4-methylbenzenesulfonate IUPAC Name: ethyl-dimethyl-phenylazanium; 4-methylbenzenesulfonate Traditional Name: ethyl-dimethyl-phenyl-ammonium tosylate Formula: C17H23NO3S MolecularWeight: 321.43442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H16N.C7H8O3S/c1-4-11(2,3)10-8-6-5-7-9-10;1-6-2-4-7(5-3-6)11(8,9)10/h5-9H,4H2,1-3H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1