4-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]-2-oxidanyl-benzoic acid

Systemtic Name: 4-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]-2-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-4-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]benzoic acid CAS Name: 2-hydroxy-4-[2-(1-methyl-1-piperidin-1-iumyl)ethoxy]benzoic acid IUPAC Name: 2-hydroxy-4-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]benzoic acid Traditional Name: 2-hydroxy-4-[2-(1-methylpiperidin-1-ium-1-yl)ethoxy]benzoic acid Formula: C15H22NO4+ MolecularWeight: 280.33948

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCCCC1)CCOC2=CC(=C(C=C2)C(=O)O)O

Isomeric SMILES

C[N+]1(CCCCC1)CCOC2=CC(=C(C=C2)C(=O)O)O

InChI

InChI=1S/C15H21NO4/c1-16(7-3-2-4-8-16)9-10-20-12-5-6-13(15(18)19)14(17)11-12/h5-6,11H,2-4,7-10H2,1H3,(H-,17,18,19)/p+1