[3-methoxy-4-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]phenyl] methanesulfonate

Systemtic Name: [3-methoxy-4-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]phenyl] methanesulfonate Openeye Name: [3-methoxy-4-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]phenyl] methanesulfonate CAS Name: methanesulfonic acid [3-methoxy-4-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]phenyl] ester IUPAC Name: [3-methoxy-4-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]phenyl] methanesulfonate Traditional Name: methanesulfonic acid [3-methoxy-4-[6-(trifluoromethyl)-1H-benzimidazol-2-yl]phenyl] ester Formula: C16H13F3N2O4S MolecularWeight: 386.34563

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)OS(=O)(=O)C)C2=NC3=C(N2)C=C(C=C3)C(F)(F)F

Isomeric SMILES

COC1=C(C=CC(=C1)OS(=O)(=O)C)C2=NC3=C(N2)C=C(C=C3)C(F)(F)F

InChI

InChI=1S/C16H13F3N2O4S/c1-24-14-8-10(25-26(2,22)23)4-5-11(14)15-20-12-6-3-9(16(17,18)19)7-13(12)21-15/h3-8H,1-2H3,(H,20,21)