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

Systemtic Name: 2-[2-(4-ethylpiperazin-4-ium-1-yl)ethoxy]benzoate Openeye Name: 2-[2-(4-ethylpiperazin-4-ium-1-yl)ethoxy]benzoate CAS Name: 2-[2-(4-ethyl-1-piperazin-4-iumyl)ethoxy]benzoate IUPAC Name: 2-[2-(4-ethylpiperazin-4-ium-1-yl)ethoxy]benzoate Traditional Name: 2-[2-(4-ethylpiperazin-4-ium-1-yl)ethoxy]benzoate Formula: C15H22N2O3 MolecularWeight: 278.34678

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)CCOC2=CC=CC=C2C(=O)[O-]

Isomeric SMILES

CC[NH+]1CCN(CC1)CCOC2=CC=CC=C2C(=O)[O-]

InChI

InChI=1S/C15H22N2O3/c1-2-16-7-9-17(10-8-16)11-12-20-14-6-4-3-5-13(14)15(18)19/h3-6H,2,7-12H2,1H3,(H,18,19)