2-phenoxy-1-piperazin-4-ium-1-yl-ethanone

Systemtic Name: 2-phenoxy-1-piperazin-4-ium-1-yl-ethanone Openeye Name: 2-phenoxy-1-piperazin-4-ium-1-yl-ethanone CAS Name: 2-phenoxy-1-(1-piperazin-4-iumyl)ethanone IUPAC Name: 2-phenoxy-1-piperazin-4-ium-1-ylethanone Traditional Name: 2-phenoxy-1-piperazin-4-ium-1-yl-ethanone Formula: C12H17N2O2+ MolecularWeight: 221.27558

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C(=O)COC2=CC=CC=C2

Isomeric SMILES

C1CN(CC[NH2+]1)C(=O)COC2=CC=CC=C2

InChI

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