N-methyl-N-[(3-methylthiophen-2-yl)methyl]-1-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperidine-4-carboxamide

Systemtic Name: N-methyl-N-[(3-methylthiophen-2-yl)methyl]-1-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperidine-4-carboxamide Openeye Name: N-methyl-N-[(3-methyl-2-thienyl)methyl]-1-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperidine-4-carboxamide CAS Name: N-methyl-N-[(3-methyl-2-thiophenyl)methyl]-1-[5-(trifluoromethyl)-2-pyridin-1-iumyl]-4-piperidinecarboxamide IUPAC Name: N-methyl-N-[(3-methylthiophen-2-yl)methyl]-1-[5-(trifluoromethyl)pyridin-1-ium-2-yl]piperidine-4-carboxamide Traditional Name: N-methyl-N-[(3-methyl-2-thienyl)methyl]-1-[5-(trifluoromethyl)pyridin-1-ium-2-yl]isonipecotamide Formula: C19H23F3N3OS+ MolecularWeight: 398.46563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CN(C)C(=O)C2CCN(CC2)C3=[NH+]C=C(C=C3)C(F)(F)F

Isomeric SMILES

CC1=C(SC=C1)CN(C)C(=O)C2CCN(CC2)C3=[NH+]C=C(C=C3)C(F)(F)F

InChI

InChI=1S/C19H22F3N3OS/c1-13-7-10-27-16(13)12-24(2)18(26)14-5-8-25(9-6-14)17-4-3-15(11-23-17)19(20,21)22/h3-4,7,10-11,14H,5-6,8-9,12H2,1-2H3/p+1