[(1S,3R)-2-bicyclo[1.1.0]butanyl]methyl-triethyl-azanium; 4-methylbenzenesulfonate

Systemtic Name: [(1S,3R)-2-bicyclo[1.1.0]butanyl]methyl-triethyl-azanium; 4-methylbenzenesulfonate Openeye Name: [(1S,3R)-2-bicyclo[1.1.0]butanyl]methyl-triethyl-ammonium; 4-methylbenzenesulfonate CAS Name: [(1S,3R)-2-bicyclo[1.1.0]butanyl]methyl-triethylammonium; 4-methylbenzenesulfonate IUPAC Name: [(1S,3R)-2-bicyclo[1.1.0]butanyl]methyl-triethylazanium; 4-methylbenzenesulfonate Traditional Name: [(1S,3R)-2-bicyclo[1.1.0]butanyl]methyl-triethyl-ammonium tosylate Formula: C18H29NO3S MolecularWeight: 339.49276

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CC)(CC)CC1C2C1C2.CC1=CC=C(C=C1)S(=O)(=O)[O-]

Isomeric SMILES

CC[N+](CC)(CC)CC1[C@H]2[C@@H]1C2.CC1=CC=C(C=C1)S(=O)(=O)[O-]

InChI

InChI=1S/C11H22N.C7H8O3S/c1-4-12(5-2,6-3)8-11-9-7-10(9)11;1-6-2-4-7(5-3-6)11(8,9)10/h9-11H,4-8H2,1-3H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1/t9-,10+,11?;