3-(4-methoxyphenyl)-1-piperazin-4-ium-1-yl-propan-1-one

Systemtic Name: 3-(4-methoxyphenyl)-1-piperazin-4-ium-1-yl-propan-1-one Openeye Name: 3-(4-methoxyphenyl)-1-piperazin-4-ium-1-yl-propan-1-one CAS Name: 3-(4-methoxyphenyl)-1-(1-piperazin-4-iumyl)-1-propanone IUPAC Name: 3-(4-methoxyphenyl)-1-piperazin-4-ium-1-ylpropan-1-one Traditional Name: 3-(4-methoxyphenyl)-1-piperazin-4-ium-1-yl-propan-1-one Formula: C14H21N2O2+ MolecularWeight: 249.32874

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC(=O)N2CC[NH2+]CC2

Isomeric SMILES

COC1=CC=C(C=C1)CCC(=O)N2CC[NH2+]CC2

InChI

InChI=1S/C14H20N2O2/c1-18-13-5-2-12(3-6-13)4-7-14(17)16-10-8-15-9-11-16/h2-3,5-6,15H,4,7-11H2,1H3/p+1