2-dodecylbenzenesulfonate; (2,3,4-tributylphenyl)phosphanium

Systemtic Name: 2-dodecylbenzenesulfonate; (2,3,4-tributylphenyl)phosphanium Openeye Name: 2-dodecylbenzenesulfonate; (2,3,4-tributylphenyl)phosphonium CAS Name: 2-dodecylbenzenesulfonate; (2,3,4-tributylphenyl)phosphonium IUPAC Name: 2-dodecylbenzenesulfonate; (2,3,4-tributylphenyl)phosphanium Traditional Name: 2-laurylbesylate; (2,3,4-tributylphenyl)phosphonium Formula: C36H61O3PS MolecularWeight: 604.906501

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].CCCCC1=C(C(=C(C=C1)[PH3+])CCCC)CCCC

Isomeric SMILES

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].CCCCC1=C(C(=C(C=C1)[PH3+])CCCC)CCCC

InChI

InChI=1S/C18H30O3S.C18H31P/c1-2-3-4-5-6-7-8-9-10-11-14-17-15-12-13-16-18(17)22(19,20)21;1-4-7-10-15-13-14-18(19)17(12-9-6-3)16(15)11-8-5-2/h12-13,15-16H,2-11,14H2,1H3,(H,19,20,21);13-14H,4-12,19H2,1-3H3