N-[[(3R)-1-cyclopentylpiperidin-1-ium-3-yl]methyl]-N-[(6-methylpyridin-2-yl)methyl]-2-piperidin-1-ium-1-yl-ethanamine

Systemtic Name: N-[[(3R)-1-cyclopentylpiperidin-1-ium-3-yl]methyl]-N-[(6-methylpyridin-2-yl)methyl]-2-piperidin-1-ium-1-yl-ethanamine Openeye Name: N-[[(3R)-1-cyclopentylpiperidin-1-ium-3-yl]methyl]-N-[(6-methyl-2-pyridyl)methyl]-2-piperidin-1-ium-1-yl-ethanamine CAS Name: N-[[(3R)-1-cyclopentyl-3-piperidin-1-iumyl]methyl]-N-[(6-methyl-2-pyridinyl)methyl]-2-(1-piperidin-1-iumyl)ethanamine IUPAC Name: N-[[(3R)-1-cyclopentylpiperidin-1-ium-3-yl]methyl]-N-[(6-methylpyridin-2-yl)methyl]-2-piperidin-1-ium-1-ylethanamine Traditional Name: [(3R)-1-cyclopentylpiperidin-1-ium-3-yl]methyl-[(6-methyl-2-pyridyl)methyl]-(2-piperidin-1-ium-1-ylethyl)amine Formula: C25H44N4+2 MolecularWeight: 400.64366

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)CN(CC[NH+]2CCCCC2)CC3CCC[NH+](C3)C4CCCC4

Isomeric SMILES

CC1=NC(=CC=C1)CN(CC[NH+]2CCCCC2)C[C@H]3CCC[NH+](C3)C4CCCC4

InChI

InChI=1S/C25H42N4/c1-22-9-7-11-24(26-22)21-28(18-17-27-14-5-2-6-15-27)19-23-10-8-16-29(20-23)25-12-3-4-13-25/h7,9,11,23,25H,2-6,8,10,12-21H2,1H3/p+2/t23-/m1/s1