(4-methoxy-2-oxidanylidene-chromen-7-yl)-diphenyl-sulfanium; 4-methylbenzenesulfonate

Systemtic Name: (4-methoxy-2-oxidanylidene-chromen-7-yl)-diphenyl-sulfanium; 4-methylbenzenesulfonate Openeye Name: (4-methoxy-2-oxo-chromen-7-yl)-diphenyl-sulfonium; 4-methylbenzenesulfonate CAS Name: (4-methoxy-2-oxo-1-benzopyran-7-yl)-diphenylsulfonium; 4-methylbenzenesulfonate IUPAC Name: (4-methoxy-2-oxochromen-7-yl)-diphenylsulfanium; 4-methylbenzenesulfonate Traditional Name: (2-keto-4-methoxy-chromen-7-yl)-diphenyl-sulfonium tosylate Formula: C29H24O6S2 MolecularWeight: 532.62726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)[O-].COC1=CC(=O)OC2=C1C=CC(=C2)[S+](C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)[O-].COC1=CC(=O)OC2=C1C=CC(=C2)[S+](C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C22H17O3S.C7H8O3S/c1-24-20-15-22(23)25-21-14-18(12-13-19(20)21)26(16-8-4-2-5-9-16)17-10-6-3-7-11-17;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