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

Systemtic Name: (2R)-1-phenethyl-N-(4-pyridin-3-yloxyphenyl)piperidin-1-ium-2-carboxamide Openeye Name: (2R)-1-phenethyl-N-[4-(3-pyridyloxy)phenyl]piperidin-1-ium-2-carboxamide CAS Name: (2R)-1-phenethyl-N-[4-(3-pyridinyloxy)phenyl]-2-piperidin-1-iumcarboxamide IUPAC Name: (2R)-1-phenethyl-N-(4-pyridin-3-yloxyphenyl)piperidin-1-ium-2-carboxamide Traditional Name: (2R)-1-phenethyl-N-[4-(3-pyridyloxy)phenyl]piperidin-1-ium-2-carboxamide Formula: C25H28N3O2+ MolecularWeight: 402.50872

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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)CCC4=CC=CC=C4

Isomeric SMILES

C1CC[NH+]([C@H](C1)C(=O)NC2=CC=C(C=C2)OC3=CN=CC=C3)CCC4=CC=CC=C4

InChI

InChI=1S/C25H27N3O2/c29-25(24-10-4-5-17-28(24)18-15-20-7-2-1-3-8-20)27-21-11-13-22(14-12-21)30-23-9-6-16-26-19-23/h1-3,6-9,11-14,16,19,24H,4-5,10,15,17-18H2,(H,27,29)/p+1/t24-/m1/s1