N-(6-phenoxypyridin-3-yl)-1-(pyridin-3-ylmethyl)piperidin-1-ium-4-carboxamide

Systemtic Name: N-(6-phenoxypyridin-3-yl)-1-(pyridin-3-ylmethyl)piperidin-1-ium-4-carboxamide Openeye Name: N-(6-phenoxy-3-pyridyl)-1-(3-pyridylmethyl)piperidin-1-ium-4-carboxamide CAS Name: N-(6-phenoxy-3-pyridinyl)-1-(3-pyridinylmethyl)-4-piperidin-1-iumcarboxamide IUPAC Name: N-(6-phenoxypyridin-3-yl)-1-(pyridin-3-ylmethyl)piperidin-1-ium-4-carboxamide Traditional Name: N-(6-phenoxy-3-pyridyl)-1-(3-pyridylmethyl)piperidin-1-ium-4-carboxamide Formula: C23H25N4O2+ MolecularWeight: 389.4702

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)NC2=CN=C(C=C2)OC3=CC=CC=C3)CC4=CN=CC=C4

Isomeric SMILES

C1C[NH+](CCC1C(=O)NC2=CN=C(C=C2)OC3=CC=CC=C3)CC4=CN=CC=C4

InChI

InChI=1S/C23H24N4O2/c28-23(19-10-13-27(14-11-19)17-18-5-4-12-24-15-18)26-20-8-9-22(25-16-20)29-21-6-2-1-3-7-21/h1-9,12,15-16,19H,10-11,13-14,17H2,(H,26,28)/p+1