1-[3-chloranyl-5-(trifluoromethyl)pyridin-1-ium-2-yl]-N-[(1R)-2-methyl-1-thiophen-2-yl-propyl]piperidine-4-carboxamide

Systemtic Name: 1-[3-chloranyl-5-(trifluoromethyl)pyridin-1-ium-2-yl]-N-[(1R)-2-methyl-1-thiophen-2-yl-propyl]piperidine-4-carboxamide Openeye Name: 1-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]-N-[(1R)-2-methyl-1-(2-thienyl)propyl]piperidine-4-carboxamide CAS Name: 1-[3-chloro-5-(trifluoromethyl)-2-pyridin-1-iumyl]-N-[(1R)-2-methyl-1-thiophen-2-ylpropyl]-4-piperidinecarboxamide IUPAC Name: 1-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]-N-[(1R)-2-methyl-1-thiophen-2-ylpropyl]piperidine-4-carboxamide Traditional Name: 1-[3-chloro-5-(trifluoromethyl)pyridin-1-ium-2-yl]-N-[(1R)-2-methyl-1-(2-thienyl)propyl]isonipecotamide Formula: C20H24ClF3N3OS+ MolecularWeight: 446.93727

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=CS1)NC(=O)C2CCN(CC2)C3=C(C=C(C=[NH+]3)C(F)(F)F)Cl

Isomeric SMILES

CC(C)[C@H](C1=CC=CS1)NC(=O)C2CCN(CC2)C3=C(C=C(C=[NH+]3)C(F)(F)F)Cl

InChI

InChI=1S/C20H23ClF3N3OS/c1-12(2)17(16-4-3-9-29-16)26-19(28)13-5-7-27(8-6-13)18-15(21)10-14(11-25-18)20(22,23)24/h3-4,9-13,17H,5-8H2,1-2H3,(H,26,28)/p+1/t17-/m1/s1