3-methoxy-2-(2-pyrrolidin-1-ium-1-ylethoxy)benzoate

Systemtic Name: 3-methoxy-2-(2-pyrrolidin-1-ium-1-ylethoxy)benzoate Openeye Name: 3-methoxy-2-(2-pyrrolidin-1-ium-1-ylethoxy)benzoate CAS Name: 3-methoxy-2-[2-(1-pyrrolidin-1-iumyl)ethoxy]benzoate IUPAC Name: 3-methoxy-2-(2-pyrrolidin-1-ium-1-ylethoxy)benzoate Traditional Name: 3-methoxy-2-(2-pyrrolidin-1-ium-1-ylethoxy)benzoate Formula: C14H19NO4 MolecularWeight: 265.30496

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OCC[NH+]2CCCC2)C(=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1OCC[NH+]2CCCC2)C(=O)[O-]

InChI

InChI=1S/C14H19NO4/c1-18-12-6-4-5-11(14(16)17)13(12)19-10-9-15-7-2-3-8-15/h4-6H,2-3,7-10H2,1H3,(H,16,17)