(2R)-1-(pyridin-3-ylmethyl)-N-(4-pyridin-3-yloxyphenyl)piperidin-1-ium-2-carboxamide

Systemtic Name: (2R)-1-(pyridin-3-ylmethyl)-N-(4-pyridin-3-yloxyphenyl)piperidin-1-ium-2-carboxamide Openeye Name: (2R)-1-(3-pyridylmethyl)-N-[4-(3-pyridyloxy)phenyl]piperidin-1-ium-2-carboxamide CAS Name: (2R)-1-(3-pyridinylmethyl)-N-[4-(3-pyridinyloxy)phenyl]-2-piperidin-1-iumcarboxamide IUPAC Name: (2R)-1-(pyridin-3-ylmethyl)-N-(4-pyridin-3-yloxyphenyl)piperidin-1-ium-2-carboxamide Traditional Name: (2R)-1-(3-pyridylmethyl)-N-[4-(3-pyridyloxy)phenyl]piperidin-1-ium-2-carboxamide Formula: C23H25N4O2+ MolecularWeight: 389.4702

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C(C1)C(=O)NC2=CC=C(C=C2)OC3=CN=CC=C3)CC4=CN=CC=C4

Isomeric SMILES

C1CC[NH+]([C@H](C1)C(=O)NC2=CC=C(C=C2)OC3=CN=CC=C3)CC4=CN=CC=C4

InChI

InChI=1S/C23H24N4O2/c28-23(22-7-1-2-14-27(22)17-18-5-3-12-24-15-18)26-19-8-10-20(11-9-19)29-21-6-4-13-25-16-21/h3-6,8-13,15-16,22H,1-2,7,14,17H2,(H,26,28)/p+1/t22-/m1/s1