[4,6-dimethoxy-3-[1-(phenylmethyl)indol-3-yl]carbonyl-pyridin-2-yl] tris(fluoranyl)methanesulfonate

Systemtic Name: [4,6-dimethoxy-3-[1-(phenylmethyl)indol-3-yl]carbonyl-pyridin-2-yl] tris(fluoranyl)methanesulfonate Openeye Name: [3-(1-benzylindole-3-carbonyl)-4,6-dimethoxy-2-pyridyl] trifluoromethanesulfonate CAS Name: trifluoromethanesulfonic acid [4,6-dimethoxy-3-[oxo-[1-(phenylmethyl)-3-indolyl]methyl]-2-pyridinyl] ester IUPAC Name: [3-(1-benzylindole-3-carbonyl)-4,6-dimethoxypyridin-2-yl] trifluoromethanesulfonate Traditional Name: trifluoromethanesulfonic acid [3-(1-benzylindole-3-carbonyl)-4,6-dimethoxy-2-pyridyl] ester Formula: C24H19F3N2O6S MolecularWeight: 520.47767

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=NC(=C1C(=O)C2=CN(C3=CC=CC=C32)CC4=CC=CC=C4)OS(=O)(=O)C(F)(F)F)OC

Isomeric SMILES

COC1=CC(=NC(=C1C(=O)C2=CN(C3=CC=CC=C32)CC4=CC=CC=C4)OS(=O)(=O)C(F)(F)F)OC

InChI

InChI=1S/C24H19F3N2O6S/c1-33-19-12-20(34-2)28-23(35-36(31,32)24(25,26)27)21(19)22(30)17-14-29(13-15-8-4-3-5-9-15)18-11-7-6-10-16(17)18/h3-12,14H,13H2,1-2H3