N-methyl-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-1-[1-[(6-methylpyridin-2-yl)methyl]piperidin-1-ium-4-yl]piperidin-1-ium-4-carboxamide

Systemtic Name: N-methyl-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-1-[1-[(6-methylpyridin-2-yl)methyl]piperidin-1-ium-4-yl]piperidin-1-ium-4-carboxamide Openeye Name: N-methyl-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-1-[1-[(6-methyl-2-pyridyl)methyl]piperidin-1-ium-4-yl]piperidin-1-ium-4-carboxamide CAS Name: N-methyl-N-[[(3R)-1-methyl-3-piperidin-1-iumyl]methyl]-1-[1-[(6-methyl-2-pyridinyl)methyl]-4-piperidin-1-iumyl]-4-piperidin-1-iumcarboxamide IUPAC Name: N-methyl-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-1-[1-[(6-methylpyridin-2-yl)methyl]piperidin-1-ium-4-yl]piperidin-1-ium-4-carboxamide Traditional Name: N-methyl-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-1-[1-[(6-methyl-2-pyridyl)methyl]piperidin-1-ium-4-yl]piperidin-1-ium-4-carboxamide Formula: C26H46N5O+3 MolecularWeight: 444.67634

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)C[NH+]2CCC(CC2)[NH+]3CCC(CC3)C(=O)N(C)CC4CCC[NH+](C4)C

Isomeric SMILES

CC1=NC(=CC=C1)C[NH+]2CCC(CC2)[NH+]3CCC(CC3)C(=O)N(C)C[C@H]4CCC[NH+](C4)C

InChI

InChI=1S/C26H43N5O/c1-21-6-4-8-24(27-21)20-30-14-11-25(12-15-30)31-16-9-23(10-17-31)26(32)29(3)19-22-7-5-13-28(2)18-22/h4,6,8,22-23,25H,5,7,9-20H2,1-3H3/p+3/t22-/m0/s1