(3-methoxyphenyl)-diphenyl-sulfanium; 4-methylbenzenesulfonate

Systemtic Name: (3-methoxyphenyl)-diphenyl-sulfanium; 4-methylbenzenesulfonate Openeye Name: (3-methoxyphenyl)-diphenyl-sulfonium; 4-methylbenzenesulfonate CAS Name: (3-methoxyphenyl)-diphenylsulfonium; 4-methylbenzenesulfonate IUPAC Name: (3-methoxyphenyl)-diphenylsulfanium; 4-methylbenzenesulfonate Traditional Name: (3-methoxyphenyl)-diphenyl-sulfonium tosylate Formula: C26H24O4S2 MolecularWeight: 464.59636

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].COC1=CC(=CC=C1)[S+](C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].COC1=CC(=CC=C1)[S+](C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C19H17OS.C7H8O3S/c1-20-16-9-8-14-19(15-16)21(17-10-4-2-5-11-17)18-12-6-3-7-13-18;1-6-2-4-7(5-3-6)11(8,9)10/h2-15H,1H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1