2-(4-phenylpiperazin-1-ium-1-yl)ethanoate

Systemtic Name: 2-(4-phenylpiperazin-1-ium-1-yl)ethanoate Openeye Name: 2-(4-phenylpiperazin-1-ium-1-yl)acetate CAS Name: 2-(4-phenyl-1-piperazin-1-iumyl)acetate IUPAC Name: 2-(4-phenylpiperazin-1-ium-1-yl)acetate Traditional Name: 2-(4-phenylpiperazin-1-ium-1-yl)acetate Formula: C12H16N2O2 MolecularWeight: 220.26764

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)[O-])C2=CC=CC=C2

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)[O-])C2=CC=CC=C2

InChI

InChI=1S/C12H16N2O2/c15-12(16)10-13-6-8-14(9-7-13)11-4-2-1-3-5-11/h1-5H,6-10H2,(H,15,16)