dodecane-1-sulfonic acid; 4-ethyl-4-hexadecyl-morpholin-4-ium

Systemtic Name: dodecane-1-sulfonic acid; 4-ethyl-4-hexadecyl-morpholin-4-ium Openeye Name: dodecane-1-sulfonic acid; 4-ethyl-4-hexadecyl-morpholin-4-ium CAS Name: 1-dodecanesulfonic acid; 4-ethyl-4-hexadecylmorpholin-4-ium IUPAC Name: dodecane-1-sulfonic acid; 4-ethyl-4-hexadecylmorpholin-4-ium Traditional Name: 4-cetyl-4-ethyl-morpholin-4-ium; dodecane-1-sulfonic acid Formula: C34H72NO4S+ MolecularWeight: 591.00478

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+]1(CCOCC1)CC.CCCCCCCCCCCCS(=O)(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+]1(CCOCC1)CC.CCCCCCCCCCCCS(=O)(=O)O

InChI

InChI=1S/C22H46NO.C12H26O3S/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23(4-2)19-21-24-22-20-23;1-2-3-4-5-6-7-8-9-10-11-12-16(13,14)15/h3-22H2,1-2H3;2-12H2,1H3,(H,13,14,15)/q+1;