3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]propanoate

Systemtic Name: 3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]propanoate Openeye Name: 3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]propanoate CAS Name: 3-[4-(2-methoxyphenyl)-1-piperazin-1-iumyl]propanoate IUPAC Name: 3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]propanoate Traditional Name: 3-[4-(2-methoxyphenyl)piperazin-1-ium-1-yl]propionate Formula: C14H20N2O3 MolecularWeight: 264.3202

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CC[NH+](CC2)CCC(=O)[O-]

Isomeric SMILES

COC1=CC=CC=C1N2CC[NH+](CC2)CCC(=O)[O-]

InChI

InChI=1S/C14H20N2O3/c1-19-13-5-3-2-4-12(13)16-10-8-15(9-11-16)7-6-14(17)18/h2-5H,6-11H2,1H3,(H,17,18)