(3S)-1-[1-(cyclopentylmethyl)piperidin-1-ium-4-yl]-N-(pyridin-2-ylmethyl)piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-1-[1-(cyclopentylmethyl)piperidin-1-ium-4-yl]-N-(pyridin-2-ylmethyl)piperidin-1-ium-3-carboxamide Openeye Name: (3S)-1-[1-(cyclopentylmethyl)piperidin-1-ium-4-yl]-N-(2-pyridylmethyl)piperidin-1-ium-3-carboxamide CAS Name: (3S)-1-[1-(cyclopentylmethyl)-4-piperidin-1-iumyl]-N-(2-pyridinylmethyl)-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-1-[1-(cyclopentylmethyl)piperidin-1-ium-4-yl]-N-(pyridin-2-ylmethyl)piperidin-1-ium-3-carboxamide Traditional Name: (3S)-1-[1-(cyclopentylmethyl)piperidin-1-ium-4-yl]-N-(2-pyridylmethyl)piperidin-1-ium-3-carboxamide Formula: C23H38N4O+2 MolecularWeight: 386.57402

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C[NH+]2CCC(CC2)[NH+]3CCCC(C3)C(=O)NCC4=CC=CC=N4

Isomeric SMILES

C1CCC(C1)C[NH+]2CCC(CC2)[NH+]3CCC[C@@H](C3)C(=O)NCC4=CC=CC=N4

InChI

InChI=1S/C23H36N4O/c28-23(25-16-21-9-3-4-12-24-21)20-8-5-13-27(18-20)22-10-14-26(15-11-22)17-19-6-1-2-7-19/h3-4,9,12,19-20,22H,1-2,5-8,10-11,13-18H2,(H,25,28)/p+2/t20-/m0/s1