[4-(1-benzothiophen-3-ylcarbonyl)-3-methoxy-5-(4-methoxyphenyl)phenyl] tris(fluoranyl)methanesulfonate

Systemtic Name: [4-(1-benzothiophen-3-ylcarbonyl)-3-methoxy-5-(4-methoxyphenyl)phenyl] tris(fluoranyl)methanesulfonate Openeye Name: [4-(benzothiophene-3-carbonyl)-3-methoxy-5-(4-methoxyphenyl)phenyl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [4-[1-benzothiophen-3-yl(oxo)methyl]-3-methoxy-5-(4-methoxyphenyl)phenyl] ester IUPAC Name: [4-(1-benzothiophene-3-carbonyl)-3-methoxy-5-(4-methoxyphenyl)phenyl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [4-(benzothiophene-3-carbonyl)-3-methoxy-5-(4-methoxyphenyl)phenyl] ester Formula: C24H17F3O6S2 MolecularWeight: 522.51339

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=CC(=C2C(=O)C3=CSC4=CC=CC=C43)OC)OS(=O)(=O)C(F)(F)F

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=CC(=C2C(=O)C3=CSC4=CC=CC=C43)OC)OS(=O)(=O)C(F)(F)F

InChI

InChI=1S/C24H17F3O6S2/c1-31-15-9-7-14(8-10-15)18-11-16(33-35(29,30)24(25,26)27)12-20(32-2)22(18)23(28)19-13-34-21-6-4-3-5-17(19)21/h3-13H,1-2H3