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

Systemtic Name: N-[2-[(2R)-1-methylpiperidin-1-ium-2-yl]ethyl]-6-(4-propylpiperazin-4-ium-1-yl)pyridine-3-carboxamide Openeye Name: N-[2-[(2R)-1-methylpiperidin-1-ium-2-yl]ethyl]-6-(4-propylpiperazin-4-ium-1-yl)pyridine-3-carboxamide CAS Name: N-[2-[(2R)-1-methyl-2-piperidin-1-iumyl]ethyl]-6-(4-propyl-1-piperazin-4-iumyl)-3-pyridinecarboxamide IUPAC Name: N-[2-[(2R)-1-methylpiperidin-1-ium-2-yl]ethyl]-6-(4-propylpiperazin-4-ium-1-yl)pyridine-3-carboxamide Traditional Name: N-[2-[(2R)-1-methylpiperidin-1-ium-2-yl]ethyl]-6-(4-propylpiperazin-4-ium-1-yl)nicotinamide Formula: C21H37N5O+2 MolecularWeight: 375.55138

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H35N5O/c1-3-11-25-13-15-26(16-14-25)20-8-7-18(17-23-20)21(27)22-10-9-19-6-4-5-12-24(19)2/h7-8,17,19H,3-6,9-16H2,1-2H3,(H,22,27)/p+2/t19-/m1/s1