N-(1-cyclopropylpiperidin-1-ium-4-yl)-3,5-bis(trifluoromethyl)benzenesulfonamide

Systemtic Name: N-(1-cyclopropylpiperidin-1-ium-4-yl)-3,5-bis(trifluoromethyl)benzenesulfonamide Openeye Name: N-(1-cyclopropylpiperidin-1-ium-4-yl)-3,5-bis(trifluoromethyl)benzenesulfonamide CAS Name: N-(1-cyclopropyl-4-piperidin-1-iumyl)-3,5-bis(trifluoromethyl)benzenesulfonamide IUPAC Name: N-(1-cyclopropylpiperidin-1-ium-4-yl)-3,5-bis(trifluoromethyl)benzenesulfonamide Traditional Name: N-(1-cyclopropylpiperidin-1-ium-4-yl)-3,5-bis(trifluoromethyl)benzenesulfonamide Formula: C16H19F6N2O2S+ MolecularWeight: 417.389679

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1[NH+]2CCC(CC2)NS(=O)(=O)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

Isomeric SMILES

C1CC1[NH+]2CCC(CC2)NS(=O)(=O)C3=CC(=CC(=C3)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C16H18F6N2O2S/c17-15(18,19)10-7-11(16(20,21)22)9-14(8-10)27(25,26)23-12-3-5-24(6-4-12)13-1-2-13/h7-9,12-13,23H,1-6H2/p+1