1-[4-(3-phenylpropyl)piperazin-4-ium-1-yl]ethanone

Systemtic Name: 1-[4-(3-phenylpropyl)piperazin-4-ium-1-yl]ethanone Openeye Name: 1-[4-(3-phenylpropyl)piperazin-4-ium-1-yl]ethanone CAS Name: 1-[4-(3-phenylpropyl)-1-piperazin-4-iumyl]ethanone IUPAC Name: 1-[4-(3-phenylpropyl)piperazin-4-ium-1-yl]ethanone Traditional Name: 1-[4-(3-phenylpropyl)piperazin-4-ium-1-yl]ethanone Formula: C15H23N2O+ MolecularWeight: 247.35592

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CC[NH+](CC1)CCCC2=CC=CC=C2

Isomeric SMILES

CC(=O)N1CC[NH+](CC1)CCCC2=CC=CC=C2

InChI

InChI=1S/C15H22N2O/c1-14(18)17-12-10-16(11-13-17)9-5-8-15-6-3-2-4-7-15/h2-4,6-7H,5,8-13H2,1H3/p+1