(2S)-1-[(2-hydroxyphenyl)methyl]-N-(4-pyridin-3-yloxyphenyl)piperidin-1-ium-2-carboxamide

Systemtic Name: (2S)-1-[(2-hydroxyphenyl)methyl]-N-(4-pyridin-3-yloxyphenyl)piperidin-1-ium-2-carboxamide Openeye Name: (2S)-1-[(2-hydroxyphenyl)methyl]-N-[4-(3-pyridyloxy)phenyl]piperidin-1-ium-2-carboxamide CAS Name: (2S)-1-[(2-hydroxyphenyl)methyl]-N-[4-(3-pyridinyloxy)phenyl]-2-piperidin-1-iumcarboxamide IUPAC Name: (2S)-1-[(2-hydroxyphenyl)methyl]-N-(4-pyridin-3-yloxyphenyl)piperidin-1-ium-2-carboxamide Traditional Name: (2S)-N-[4-(3-pyridyloxy)phenyl]-1-salicyl-piperidin-1-ium-2-carboxamide Formula: C24H26N3O3+ MolecularWeight: 404.48154

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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=CC=CC=C4O

Isomeric SMILES

C1CC[NH+]([C@@H](C1)C(=O)NC2=CC=C(C=C2)OC3=CN=CC=C3)CC4=CC=CC=C4O

InChI

InChI=1S/C24H25N3O3/c28-23-9-2-1-6-18(23)17-27-15-4-3-8-22(27)24(29)26-19-10-12-20(13-11-19)30-21-7-5-14-25-16-21/h1-2,5-7,9-14,16,22,28H,3-4,8,15,17H2,(H,26,29)/p+1/t22-/m0/s1