4-[2-(4-methylpiperidin-1-ium-1-yl)ethoxy]benzoate

Systemtic Name: 4-[2-(4-methylpiperidin-1-ium-1-yl)ethoxy]benzoate Openeye Name: 4-[2-(4-methylpiperidin-1-ium-1-yl)ethoxy]benzoate CAS Name: 4-[2-(4-methyl-1-piperidin-1-iumyl)ethoxy]benzoate IUPAC Name: 4-[2-(4-methylpiperidin-1-ium-1-yl)ethoxy]benzoate Traditional Name: 4-[2-(4-methylpiperidin-1-ium-1-yl)ethoxy]benzoate Formula: C15H21NO3 MolecularWeight: 263.33214

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CCOC2=CC=C(C=C2)C(=O)[O-]

Isomeric SMILES

CC1CC[NH+](CC1)CCOC2=CC=C(C=C2)C(=O)[O-]

InChI

InChI=1S/C15H21NO3/c1-12-6-8-16(9-7-12)10-11-19-14-4-2-13(3-5-14)15(17)18/h2-5,12H,6-11H2,1H3,(H,17,18)