4-methylbenzenesulfonate; triphenyl-(phenylmethyl)phosphanium

Systemtic Name: 4-methylbenzenesulfonate; triphenyl-(phenylmethyl)phosphanium Openeye Name: benzyl(triphenyl)phosphonium; 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonate; triphenyl-(phenylmethyl)phosphonium IUPAC Name: benzyl(triphenyl)phosphanium; 4-methylbenzenesulfonate Traditional Name: benzyl(triphenyl)phosphonium tosylate Formula: C32H29O3PS MolecularWeight: 524.609621

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].C1=CC=C(C=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].C1=CC=C(C=C1)C[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H22P.C7H8O3S/c1-5-13-22(14-6-1)21-26(23-15-7-2-8-16-23,24-17-9-3-10-18-24)25-19-11-4-12-20-25;1-6-2-4-7(5-3-6)11(8,9)10/h1-20H,21H2;2-5H,1H3,(H,8,9,10)/q+1;/p-1