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

Systemtic Name: ethyl 2-(4-phenylpiperazin-1-ium-1-yl)ethanoate Openeye Name: ethyl 2-(4-phenylpiperazin-1-ium-1-yl)acetate CAS Name: 2-(4-phenyl-1-piperazin-1-iumyl)acetic acid ethyl ester IUPAC Name: ethyl 2-(4-phenylpiperazin-1-ium-1-yl)acetate Traditional Name: 2-(4-phenylpiperazin-1-ium-1-yl)acetic acid ethyl ester Formula: C14H21N2O2+ MolecularWeight: 249.32874

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O2/c1-2-18-14(17)12-15-8-10-16(11-9-15)13-6-4-3-5-7-13/h3-7H,2,8-12H2,1H3/p+1