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

Systemtic Name: 1-phenyl-2-piperazin-4-ium-1-yl-ethanone Openeye Name: 1-phenyl-2-piperazin-4-ium-1-yl-ethanone CAS Name: 1-phenyl-2-(1-piperazin-4-iumyl)ethanone IUPAC Name: 1-phenyl-2-piperazin-4-ium-1-ylethanone Traditional Name: 1-phenyl-2-piperazin-4-ium-1-yl-ethanone Formula: C12H17N2O+ MolecularWeight: 205.27618

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16N2O/c15-12(11-4-2-1-3-5-11)10-14-8-6-13-7-9-14/h1-5,13H,6-10H2/p+1