4-methylbenzenesulfonate; methyl-diphenyl-[(E)-2-phenylethenyl]phosphanium

Systemtic Name: 4-methylbenzenesulfonate; methyl-diphenyl-[(E)-2-phenylethenyl]phosphanium Openeye Name: 4-methylbenzenesulfonate; methyl-diphenyl-[(E)-styryl]phosphonium CAS Name: 4-methylbenzenesulfonate; methyl-diphenyl-[(E)-2-phenylethenyl]phosphonium IUPAC Name: 4-methylbenzenesulfonate; methyl-diphenyl-[(E)-2-phenylethenyl]phosphanium Traditional Name: methyl-diphenyl-[(E)-styryl]phosphonium tosylate Formula: C28H27O3PS MolecularWeight: 474.550941

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20P.C7H8O3S/c1-22(20-13-7-3-8-14-20,21-15-9-4-10-16-21)18-17-19-11-5-2-6-12-19;1-6-2-4-7(5-3-6)11(8,9)10/h2-18H,1H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1/b18-17+;