dioctadecylazanium; 4-methylbenzenesulfonate

Systemtic Name: dioctadecylazanium; 4-methylbenzenesulfonate Openeye Name: dioctadecylammonium; 4-methylbenzenesulfonate CAS Name: dioctadecylammonium; 4-methylbenzenesulfonate IUPAC Name: dioctadecylazanium; 4-methylbenzenesulfonate Traditional Name: distearylammonium tosylate Formula: C43H83NO3S MolecularWeight: 694.18902

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[NH2+]CCCCCCCCCCCCCCCCCC.CC1=CC=C(C=C1)S(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC[NH2+]CCCCCCCCCCCCCCCCCC.CC1=CC=C(C=C1)S(=O)(=O)[O-]

InChI

InChI=1S/C36H75N.C7H8O3S/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2;1-6-2-4-7(5-3-6)11(8,9)10/h37H,3-36H2,1-2H3;2-5H,1H3,(H,8,9,10)