[3-(1-methylpiperidin-4-yl)-1H-indol-5-yl] 2,4-bis(fluoranyl)benzenesulfonate

Systemtic Name: [3-(1-methylpiperidin-4-yl)-1H-indol-5-yl] 2,4-bis(fluoranyl)benzenesulfonate Openeye Name: [3-(1-methyl-4-piperidyl)-1H-indol-5-yl] 2,4-difluorobenzenesulfonate CAS Name: 2,4-difluorobenzenesulfonic acid [3-(1-methyl-4-piperidinyl)-1H-indol-5-yl] ester IUPAC Name: [3-(1-methylpiperidin-4-yl)-1H-indol-5-yl] 2,4-difluorobenzenesulfonate Traditional Name: 2,4-difluorobenzenesulfonic acid [3-(1-methyl-4-piperidyl)-1H-indol-5-yl] ester Formula: C20H20F2N2O3S MolecularWeight: 406.446206

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)C2=CNC3=C2C=C(C=C3)OS(=O)(=O)C4=C(C=C(C=C4)F)F

Isomeric SMILES

CN1CCC(CC1)C2=CNC3=C2C=C(C=C3)OS(=O)(=O)C4=C(C=C(C=C4)F)F

InChI

InChI=1S/C20H20F2N2O3S/c1-24-8-6-13(7-9-24)17-12-23-19-4-3-15(11-16(17)19)27-28(25,26)20-5-2-14(21)10-18(20)22/h2-5,10-13,23H,6-9H2,1H3