N-ethyl-N-[[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]methyl]-3-pyridin-2-yl-propanamide

Systemtic Name: N-ethyl-N-[[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]methyl]-3-pyridin-2-yl-propanamide Openeye Name: N-ethyl-N-[[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]methyl]-3-(2-pyridyl)propanamide CAS Name: N-ethyl-N-[[1-(1-methyl-4-piperidin-1-iumyl)-4-piperidin-1-iumyl]methyl]-3-(2-pyridinyl)propanamide IUPAC Name: N-ethyl-N-[[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]methyl]-3-pyridin-2-ylpropanamide Traditional Name: N-ethyl-N-[[1-(1-methylpiperidin-1-ium-4-yl)piperidin-1-ium-4-yl]methyl]-3-(2-pyridyl)propionamide Formula: C22H38N4O+2 MolecularWeight: 374.56332

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1CC[NH+](CC1)C2CC[NH+](CC2)C)C(=O)CCC3=CC=CC=N3

Isomeric SMILES

CCN(CC1CC[NH+](CC1)C2CC[NH+](CC2)C)C(=O)CCC3=CC=CC=N3

InChI

InChI=1S/C22H36N4O/c1-3-25(22(27)8-7-20-6-4-5-13-23-20)18-19-9-16-26(17-10-19)21-11-14-24(2)15-12-21/h4-6,13,19,21H,3,7-12,14-18H2,1-2H3/p+2