(4-methylphenyl)methanesulfonate; triphenyl-(phenylmethyl)phosphanium

Systemtic Name: (4-methylphenyl)methanesulfonate; triphenyl-(phenylmethyl)phosphanium Openeye Name: benzyl(triphenyl)phosphonium; p-tolylmethanesulfonate CAS Name: (4-methylphenyl)methanesulfonate; triphenyl-(phenylmethyl)phosphonium IUPAC Name: benzyl(triphenyl)phosphanium; (4-methylphenyl)methanesulfonate Traditional Name: benzyl(triphenyl)phosphonium; p-tolylmethanesulfonate Formula: C33H31O3PS MolecularWeight: 538.636201

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CS(=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)CS(=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.C8H10O3S/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;1-7-2-4-8(5-3-7)6-12(9,10)11/h1-20H,21H2;2-5H,6H2,1H3,(H,9,10,11)/q+1;/p-1