6-[(5-methylfuran-2-yl)methylamino]-N-[2-[(2S)-1-methylpiperidin-1-ium-2-yl]ethyl]pyridine-3-carboxamide

Systemtic Name: 6-[(5-methylfuran-2-yl)methylamino]-N-[2-[(2S)-1-methylpiperidin-1-ium-2-yl]ethyl]pyridine-3-carboxamide Openeye Name: 6-[(5-methyl-2-furyl)methylamino]-N-[2-[(2S)-1-methylpiperidin-1-ium-2-yl]ethyl]pyridine-3-carboxamide CAS Name: 6-[(5-methyl-2-furanyl)methylamino]-N-[2-[(2S)-1-methyl-2-piperidin-1-iumyl]ethyl]-3-pyridinecarboxamide IUPAC Name: 6-[(5-methylfuran-2-yl)methylamino]-N-[2-[(2S)-1-methylpiperidin-1-ium-2-yl]ethyl]pyridine-3-carboxamide Traditional Name: 6-[(5-methyl-2-furyl)methylamino]-N-[2-[(2S)-1-methylpiperidin-1-ium-2-yl]ethyl]nicotinamide Formula: C20H29N4O2+ MolecularWeight: 357.46986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)CNC2=NC=C(C=C2)C(=O)NCCC3CCCC[NH+]3C

Isomeric SMILES

CC1=CC=C(O1)CNC2=NC=C(C=C2)C(=O)NCC[C@@H]3CCCC[NH+]3C

InChI

InChI=1S/C20H28N4O2/c1-15-6-8-18(26-15)14-23-19-9-7-16(13-22-19)20(25)21-11-10-17-5-3-4-12-24(17)2/h6-9,13,17H,3-5,10-12,14H2,1-2H3,(H,21,25)(H,22,23)/p+1/t17-/m0/s1