14-diphenylphosphanyltetradecyl-methyl-bis(2-methylpropyl)phosphanium; 2-dodecylbenzenesulfonate

Systemtic Name: 14-diphenylphosphanyltetradecyl-methyl-bis(2-methylpropyl)phosphanium; 2-dodecylbenzenesulfonate Openeye Name: 14-diphenylphosphanyltetradecyl-diisobutyl-methyl-phosphonium; 2-dodecylbenzenesulfonate CAS Name: 14-diphenylphosphinotetradecyl-methyl-bis(2-methylpropyl)phosphonium; 2-dodecylbenzenesulfonate IUPAC Name: 14-diphenylphosphanyltetradecyl-methyl-bis(2-methylpropyl)phosphanium; 2-dodecylbenzenesulfonate Traditional Name: 14-diphenylphosphinotetradecyl-diisobutyl-methyl-phosphonium; 2-laurylbesylate Formula: C53H88O3P2S MolecularWeight: 867.276542

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].CC(C)C[P+](C)(CCCCCCCCCCCCCCP(C1=CC=CC=C1)C2=CC=CC=C2)CC(C)C

Isomeric SMILES

CCCCCCCCCCCCC1=CC=CC=C1S(=O)(=O)[O-].CC(C)C[P+](C)(CCCCCCCCCCCCCCP(C1=CC=CC=C1)C2=CC=CC=C2)CC(C)C

InChI

InChI=1S/C35H59P2.C18H30O3S/c1-32(2)30-37(5,31-33(3)4)29-23-15-13-11-9-7-6-8-10-12-14-22-28-36(34-24-18-16-19-25-34)35-26-20-17-21-27-35;1-2-3-4-5-6-7-8-9-10-11-14-17-15-12-13-16-18(17)22(19,20)21/h16-21,24-27,32-33H,6-15,22-23,28-31H2,1-5H3;12-13,15-16H,2-11,14H2,1H3,(H,19,20,21)/q+1;/p-1