N-[[2-[cyclohexyl(methyl)amino]pyridin-1-ium-3-yl]methyl]-6-methyl-pyridine-3-carboxamide

Systemtic Name: N-[[2-[cyclohexyl(methyl)amino]pyridin-1-ium-3-yl]methyl]-6-methyl-pyridine-3-carboxamide Openeye Name: N-[[2-[cyclohexyl(methyl)amino]pyridin-1-ium-3-yl]methyl]-6-methyl-pyridine-3-carboxamide CAS Name: N-[[2-[cyclohexyl(methyl)amino]-3-pyridin-1-iumyl]methyl]-6-methyl-3-pyridinecarboxamide IUPAC Name: N-[[2-[cyclohexyl(methyl)amino]pyridin-1-ium-3-yl]methyl]-6-methylpyridine-3-carboxamide Traditional Name: N-[[2-[cyclohexyl(methyl)amino]pyridin-1-ium-3-yl]methyl]-6-methyl-nicotinamide Formula: C20H27N4O+ MolecularWeight: 339.45458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(C=C1)C(=O)NCC2=C([NH+]=CC=C2)N(C)C3CCCCC3

Isomeric SMILES

CC1=NC=C(C=C1)C(=O)NCC2=C([NH+]=CC=C2)N(C)C3CCCCC3

InChI

InChI=1S/C20H26N4O/c1-15-10-11-17(14-22-15)20(25)23-13-16-7-6-12-21-19(16)24(2)18-8-4-3-5-9-18/h6-7,10-12,14,18H,3-5,8-9,13H2,1-2H3,(H,23,25)/p+1