4-methylbenzenesulfonate; trimethyl-[(1R,2R)-2-oxidanylcyclopentyl]azanium

Systemtic Name: 4-methylbenzenesulfonate; trimethyl-[(1R,2R)-2-oxidanylcyclopentyl]azanium Openeye Name: [(1R,2R)-2-hydroxycyclopentyl]-trimethyl-ammonium; 4-methylbenzenesulfonate CAS Name: [(1R,2R)-2-hydroxycyclopentyl]-trimethylammonium; 4-methylbenzenesulfonate IUPAC Name: [(1R,2R)-2-hydroxycyclopentyl]-trimethylazanium; 4-methylbenzenesulfonate Traditional Name: [(1R,2R)-2-hydroxycyclopentyl]-trimethyl-ammonium tosylate Formula: C15H25NO4S MolecularWeight: 315.4283

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].C[N+](C)(C)C1CCCC1O

Isomeric SMILES

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

InChI

InChI=1S/C8H18NO.C7H8O3S/c1-9(2,3)7-5-4-6-8(7)10;1-6-2-4-7(5-3-6)11(8,9)10/h7-8,10H,4-6H2,1-3H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1/t7-,8-;/m1./s1