2-[4-(1-oxidanylpiperidin-1-ium-1-yl)phenyl]carbonylbenzoic acid

Systemtic Name: 2-[4-(1-oxidanylpiperidin-1-ium-1-yl)phenyl]carbonylbenzoic acid Openeye Name: 2-[4-(1-hydroxypiperidin-1-ium-1-yl)benzoyl]benzoic acid CAS Name: 2-[[4-(1-hydroxy-1-piperidin-1-iumyl)phenyl]-oxomethyl]benzoic acid IUPAC Name: 2-[4-(1-hydroxypiperidin-1-ium-1-yl)benzoyl]benzoic acid Traditional Name: 2-[4-(1-hydroxypiperidin-1-ium-1-yl)benzoyl]benzoic acid Formula: C19H20NO4+ MolecularWeight: 326.3664

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[N+](CC1)(C2=CC=C(C=C2)C(=O)C3=CC=CC=C3C(=O)O)O

Isomeric SMILES

C1CC[N+](CC1)(C2=CC=C(C=C2)C(=O)C3=CC=CC=C3C(=O)O)O

InChI

InChI=1S/C19H19NO4/c21-18(16-6-2-3-7-17(16)19(22)23)14-8-10-15(11-9-14)20(24)12-4-1-5-13-20/h2-3,6-11,24H,1,4-5,12-13H2/p+1