4-methylbenzenesulfonate; [(E)-non-3-enyl]-triphenyl-phosphanium

Systemtic Name: 4-methylbenzenesulfonate; [(E)-non-3-enyl]-triphenyl-phosphanium Openeye Name: 4-methylbenzenesulfonate; [(E)-non-3-enyl]-triphenyl-phosphonium CAS Name: 4-methylbenzenesulfonate; [(E)-non-3-enyl]-triphenylphosphonium IUPAC Name: 4-methylbenzenesulfonate; [(E)-non-3-enyl]-triphenylphosphanium Traditional Name: [(E)-non-3-enyl]-triphenyl-phosphonium tosylate Formula: C34H39O3PS MolecularWeight: 558.710421

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC=CCC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.CC1=CC=C(C=C1)S(=O)(=O)[O-]

Isomeric SMILES

CCCCC/C=C/CC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.CC1=CC=C(C=C1)S(=O)(=O)[O-]

InChI

InChI=1S/C27H32P.C7H8O3S/c1-2-3-4-5-6-7-17-24-28(25-18-11-8-12-19-25,26-20-13-9-14-21-26)27-22-15-10-16-23-27;1-6-2-4-7(5-3-6)11(8,9)10/h6-16,18-23H,2-5,17,24H2,1H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1/b7-6+;