6-[(1-methylpiperidin-1-ium-4-yl)amino]-N-[2-[(2R)-1-methylpiperidin-1-ium-2-yl]ethyl]pyridine-3-carboxamide

Systemtic Name: 6-[(1-methylpiperidin-1-ium-4-yl)amino]-N-[2-[(2R)-1-methylpiperidin-1-ium-2-yl]ethyl]pyridine-3-carboxamide Openeye Name: 6-[(1-methylpiperidin-1-ium-4-yl)amino]-N-[2-[(2R)-1-methylpiperidin-1-ium-2-yl]ethyl]pyridine-3-carboxamide CAS Name: 6-[(1-methyl-4-piperidin-1-iumyl)amino]-N-[2-[(2R)-1-methyl-2-piperidin-1-iumyl]ethyl]-3-pyridinecarboxamide IUPAC Name: 6-[(1-methylpiperidin-1-ium-4-yl)amino]-N-[2-[(2R)-1-methylpiperidin-1-ium-2-yl]ethyl]pyridine-3-carboxamide Traditional Name: 6-[(1-methylpiperidin-1-ium-4-yl)amino]-N-[2-[(2R)-1-methylpiperidin-1-ium-2-yl]ethyl]nicotinamide Formula: C20H35N5O+2 MolecularWeight: 361.5248

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)NC2=NC=C(C=C2)C(=O)NCCC3CCCC[NH+]3C

Isomeric SMILES

C[NH+]1CCC(CC1)NC2=NC=C(C=C2)C(=O)NCC[C@H]3CCCC[NH+]3C

InChI

InChI=1S/C20H33N5O/c1-24-13-9-17(10-14-24)23-19-7-6-16(15-22-19)20(26)21-11-8-18-5-3-4-12-25(18)2/h6-7,15,17-18H,3-5,8-14H2,1-2H3,(H,21,26)(H,22,23)/p+2/t18-/m1/s1