3-ethoxy-4-(2-piperidin-1-ium-1-ylethoxy)benzoate

Systemtic Name: 3-ethoxy-4-(2-piperidin-1-ium-1-ylethoxy)benzoate Openeye Name: 3-ethoxy-4-(2-piperidin-1-ium-1-ylethoxy)benzoate CAS Name: 3-ethoxy-4-[2-(1-piperidin-1-iumyl)ethoxy]benzoate IUPAC Name: 3-ethoxy-4-(2-piperidin-1-ium-1-ylethoxy)benzoate Traditional Name: 3-ethoxy-4-(2-piperidin-1-ium-1-ylethoxy)benzoate Formula: C16H23NO4 MolecularWeight: 293.35812

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)[O-])OCC[NH+]2CCCCC2

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)[O-])OCC[NH+]2CCCCC2

InChI

InChI=1S/C16H23NO4/c1-2-20-15-12-13(16(18)19)6-7-14(15)21-11-10-17-8-4-3-5-9-17/h6-7,12H,2-5,8-11H2,1H3,(H,18,19)