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

Systemtic Name: 6-(4-ethylpiperazin-4-ium-1-yl)-N-[2-[(2R)-1-methylpiperidin-1-ium-2-yl]ethyl]pyridine-3-carboxamide Openeye Name: 6-(4-ethylpiperazin-4-ium-1-yl)-N-[2-[(2R)-1-methylpiperidin-1-ium-2-yl]ethyl]pyridine-3-carboxamide CAS Name: 6-(4-ethyl-1-piperazin-4-iumyl)-N-[2-[(2R)-1-methyl-2-piperidin-1-iumyl]ethyl]-3-pyridinecarboxamide IUPAC Name: 6-(4-ethylpiperazin-4-ium-1-yl)-N-[2-[(2R)-1-methylpiperidin-1-ium-2-yl]ethyl]pyridine-3-carboxamide Traditional Name: 6-(4-ethylpiperazin-4-ium-1-yl)-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:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H33N5O/c1-3-24-12-14-25(15-13-24)19-8-7-17(16-22-19)20(26)21-10-9-18-6-4-5-11-23(18)2/h7-8,16,18H,3-6,9-15H2,1-2H3,(H,21,26)/p+2/t18-/m1/s1