[4-[1-[4-(2-methylphenyl)sulfonyloxyphenyl]-3-oxidanylidene-2-benzofuran-1-yl]phenyl] 2-methylbenzenesulfonate

Systemtic Name: [4-[1-[4-(2-methylphenyl)sulfonyloxyphenyl]-3-oxidanylidene-2-benzofuran-1-yl]phenyl] 2-methylbenzenesulfonate Openeye Name: [4-[1-[4-(o-tolylsulfonyloxy)phenyl]-3-oxo-isobenzofuran-1-yl]phenyl] 2-methylbenzenesulfonate CAS Name: 2-methylbenzenesulfonic acid [4-[1-[4-(2-methylphenyl)sulfonyloxyphenyl]-3-oxo-1-isobenzofuranyl]phenyl] ester IUPAC Name: [4-[1-[4-(2-methylphenyl)sulfonyloxyphenyl]-3-oxo-2-benzofuran-1-yl]phenyl] 2-methylbenzenesulfonate Traditional Name: 2-methylbenzenesulfonic acid [4-[3-keto-1-[4-(o-tolylsulfonyloxy)phenyl]phthalan-1-yl]phenyl] ester Formula: C34H26O8S2 MolecularWeight: 626.69544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1S(=O)(=O)OC2=CC=C(C=C2)C3(C4=CC=CC=C4C(=O)O3)C5=CC=C(C=C5)OS(=O)(=O)C6=CC=CC=C6C

Isomeric SMILES

CC1=CC=CC=C1S(=O)(=O)OC2=CC=C(C=C2)C3(C4=CC=CC=C4C(=O)O3)C5=CC=C(C=C5)OS(=O)(=O)C6=CC=CC=C6C

InChI

InChI=1S/C34H26O8S2/c1-23-9-3-7-13-31(23)43(36,37)41-27-19-15-25(16-20-27)34(30-12-6-5-11-29(30)33(35)40-34)26-17-21-28(22-18-26)42-44(38,39)32-14-8-4-10-24(32)2/h3-22H,1-2H3