(E)-5-(1-methylpiperazin-1-ium-1-yl)-1-phenyl-pent-1-en-3-one hydrochloride

Systemtic Name: (E)-5-(1-methylpiperazin-1-ium-1-yl)-1-phenyl-pent-1-en-3-one hydrochloride Openeye Name: (E)-5-(1-methylpiperazin-1-ium-1-yl)-1-phenyl-pent-1-en-3-one hydrochloride CAS Name: (E)-5-(1-methyl-1-piperazin-1-iumyl)-1-phenyl-1-penten-3-one hydrochloride IUPAC Name: (E)-5-(1-methylpiperazin-1-ium-1-yl)-1-phenylpent-1-en-3-one hydrochloride Traditional Name: (E)-5-(1-methylpiperazin-1-ium-1-yl)-1-phenyl-pent-1-en-3-one hydrochloride Formula: C16H24ClN2O+ MolecularWeight: 295.82756

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CCNCC1)CCC(=O)C=CC2=CC=CC=C2.Cl

Isomeric SMILES

C[N+]1(CCNCC1)CCC(=O)/C=C/C2=CC=CC=C2.Cl

InChI

InChI=1S/C16H23N2O.ClH/c1-18(13-10-17-11-14-18)12-9-16(19)8-7-15-5-3-2-4-6-15;/h2-8,17H,9-14H2,1H3;1H/q+1;/b8-7+;