methylbenzene; triphenyl(sulfomethyl)phosphanium

Systemtic Name: methylbenzene; triphenyl(sulfomethyl)phosphanium Openeye Name: toluene; triphenyl(sulfomethyl)phosphonium CAS Name: toluene; triphenyl(sulfomethyl)phosphonium IUPAC Name: toluene; triphenyl(sulfomethyl)phosphanium Traditional Name: toluene; triphenyl(sulfomethyl)phosphonium Formula: C26H26O3PS+ MolecularWeight: 449.521601

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1.C1=CC=C(C=C1)[P+](CS(=O)(=O)O)(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=CC=C1.C1=CC=C(C=C1)[P+](CS(=O)(=O)O)(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C19H17O3PS.C7H8/c20-24(21,22)16-23(17-10-4-1-5-11-17,18-12-6-2-7-13-18)19-14-8-3-9-15-19;1-7-5-3-2-4-6-7/h1-15H,16H2;2-6H,1H3/p+1