6-(4-methoxypiperidin-1-yl)-N-[[(3R)-1-(2-methylpropyl)pyrrolidin-1-ium-3-yl]methyl]pyridin-1-ium-3-carboxamide

Systemtic Name: 6-(4-methoxypiperidin-1-yl)-N-[[(3R)-1-(2-methylpropyl)pyrrolidin-1-ium-3-yl]methyl]pyridin-1-ium-3-carboxamide Openeye Name: N-[[(3R)-1-isobutylpyrrolidin-1-ium-3-yl]methyl]-6-(4-methoxy-1-piperidyl)pyridin-1-ium-3-carboxamide CAS Name: 6-(4-methoxy-1-piperidinyl)-N-[[(3R)-1-(2-methylpropyl)-3-pyrrolidin-1-iumyl]methyl]-3-pyridin-1-iumcarboxamide IUPAC Name: 6-(4-methoxypiperidin-1-yl)-N-[[(3R)-1-(2-methylpropyl)pyrrolidin-1-ium-3-yl]methyl]pyridin-1-ium-3-carboxamide Traditional Name: N-[[(3R)-1-isobutylpyrrolidin-1-ium-3-yl]methyl]-6-(4-methoxypiperidino)pyridin-1-ium-3-carboxamide Formula: C21H36N4O2+2 MolecularWeight: 376.53614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[NH+]1CCC(C1)CNC(=O)C2=C[NH+]=C(C=C2)N3CCC(CC3)OC

Isomeric SMILES

CC(C)C[NH+]1CC[C@@H](C1)CNC(=O)C2=C[NH+]=C(C=C2)N3CCC(CC3)OC

InChI

InChI=1S/C21H34N4O2/c1-16(2)14-24-9-6-17(15-24)12-23-21(26)18-4-5-20(22-13-18)25-10-7-19(27-3)8-11-25/h4-5,13,16-17,19H,6-12,14-15H2,1-3H3,(H,23,26)/p+2/t17-/m1/s1