2-oxidanyl-5-(2-piperidin-1-ium-4-ylethyl)benzoate

Systemtic Name: 2-oxidanyl-5-(2-piperidin-1-ium-4-ylethyl)benzoate Openeye Name: 2-hydroxy-5-(2-piperidin-1-ium-4-ylethyl)benzoate CAS Name: 2-hydroxy-5-[2-(4-piperidin-1-iumyl)ethyl]benzoate IUPAC Name: 2-hydroxy-5-(2-piperidin-1-ium-4-ylethyl)benzoate Traditional Name: 2-hydroxy-5-(2-piperidin-1-ium-4-ylethyl)benzoate Formula: C14H19NO3 MolecularWeight: 249.30556

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCC1CCC2=CC(=C(C=C2)O)C(=O)[O-]

Isomeric SMILES

C1C[NH2+]CCC1CCC2=CC(=C(C=C2)O)C(=O)[O-]

InChI

InChI=1S/C14H19NO3/c16-13-4-3-11(9-12(13)14(17)18)2-1-10-5-7-15-8-6-10/h3-4,9-10,15-16H,1-2,5-8H2,(H,17,18)