6-[(1,5-dimethylpyrazol-4-yl)methylamino]-N-[2-[(2S)-1-methylpiperidin-1-ium-2-yl]ethyl]pyridine-3-carboxamide

Systemtic Name: 6-[(1,5-dimethylpyrazol-4-yl)methylamino]-N-[2-[(2S)-1-methylpiperidin-1-ium-2-yl]ethyl]pyridine-3-carboxamide Openeye Name: 6-[(1,5-dimethylpyrazol-4-yl)methylamino]-N-[2-[(2S)-1-methylpiperidin-1-ium-2-yl]ethyl]pyridine-3-carboxamide CAS Name: 6-[(1,5-dimethyl-4-pyrazolyl)methylamino]-N-[2-[(2S)-1-methyl-2-piperidin-1-iumyl]ethyl]-3-pyridinecarboxamide IUPAC Name: 6-[(1,5-dimethylpyrazol-4-yl)methylamino]-N-[2-[(2S)-1-methylpiperidin-1-ium-2-yl]ethyl]pyridine-3-carboxamide Traditional Name: 6-[(1,5-dimethylpyrazol-4-yl)methylamino]-N-[2-[(2S)-1-methylpiperidin-1-ium-2-yl]ethyl]nicotinamide Formula: C20H31N6O+ MolecularWeight: 371.49974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)CNC2=NC=C(C=C2)C(=O)NCCC3CCCC[NH+]3C

Isomeric SMILES

CC1=C(C=NN1C)CNC2=NC=C(C=C2)C(=O)NCC[C@@H]3CCCC[NH+]3C

InChI

InChI=1S/C20H30N6O/c1-15-17(14-24-26(15)3)13-23-19-8-7-16(12-22-19)20(27)21-10-9-18-6-4-5-11-25(18)2/h7-8,12,14,18H,4-6,9-11,13H2,1-3H3,(H,21,27)(H,22,23)/p+1/t18-/m0/s1