N-[[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl]-2-pyridin-3-yl-N-(pyridin-3-ylmethyl)ethanamide

Systemtic Name: N-[[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl]-2-pyridin-3-yl-N-(pyridin-3-ylmethyl)ethanamide Openeye Name: N-[[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl]-2-(3-pyridyl)-N-(3-pyridylmethyl)acetamide CAS Name: N-[[(3R)-1-cyclohexyl-3-piperidin-1-iumyl]methyl]-2-(3-pyridinyl)-N-(3-pyridinylmethyl)acetamide IUPAC Name: N-[[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl]-2-pyridin-3-yl-N-(pyridin-3-ylmethyl)acetamide Traditional Name: N-[[(3R)-1-cyclohexylpiperidin-1-ium-3-yl]methyl]-2-(3-pyridyl)-N-(3-pyridylmethyl)acetamide Formula: C25H35N4O+ MolecularWeight: 407.5716

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+]2CCCC(C2)CN(CC3=CN=CC=C3)C(=O)CC4=CN=CC=C4

Isomeric SMILES

C1CCC(CC1)[NH+]2CCC[C@@H](C2)CN(CC3=CN=CC=C3)C(=O)CC4=CN=CC=C4

InChI

InChI=1S/C25H34N4O/c30-25(15-21-7-4-12-26-16-21)29(18-22-8-5-13-27-17-22)20-23-9-6-14-28(19-23)24-10-2-1-3-11-24/h4-5,7-8,12-13,16-17,23-24H,1-3,6,9-11,14-15,18-20H2/p+1/t23-/m0/s1