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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)[O-])[NH+]1CCN(CC1)C2=CC=C(C=C2)OC

Isomeric SMILES

C[C@@H](C(=O)[O-])[NH+]1CCN(CC1)C2=CC=C(C=C2)OC

InChI

InChI=1S/C14H20N2O3/c1-11(14(17)18)15-7-9-16(10-8-15)12-3-5-13(19-2)6-4-12/h3-6,11H,7-10H2,1-2H3,(H,17,18)/t11-/m0/s1