1-(1-cyclohexylpiperidin-1-ium-4-yl)-N-(pyridin-2-ylmethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: 1-(1-cyclohexylpiperidin-1-ium-4-yl)-N-(pyridin-2-ylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: 1-(1-cyclohexylpiperidin-1-ium-4-yl)-N-(2-pyridylmethyl)piperidin-1-ium-4-carboxamide CAS Name: 1-(1-cyclohexyl-4-piperidin-1-iumyl)-N-(2-pyridinylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: 1-(1-cyclohexylpiperidin-1-ium-4-yl)-N-(pyridin-2-ylmethyl)piperidin-1-ium-4-carboxamide Traditional Name: 1-(1-cyclohexylpiperidin-1-ium-4-yl)-N-(2-pyridylmethyl)piperidin-1-ium-4-carboxamide Formula: C23H38N4O+2 MolecularWeight: 386.57402

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)[NH+]2CCC(CC2)[NH+]3CCC(CC3)C(=O)NCC4=CC=CC=N4

Isomeric SMILES

C1CCC(CC1)[NH+]2CCC(CC2)[NH+]3CCC(CC3)C(=O)NCC4=CC=CC=N4

InChI

InChI=1S/C23H36N4O/c28-23(25-18-20-6-4-5-13-24-20)19-9-14-26(15-10-19)22-11-16-27(17-12-22)21-7-2-1-3-8-21/h4-6,13,19,21-22H,1-3,7-12,14-18H2,(H,25,28)/p+2