1-(4-methoxyphenyl)-2-[4-(phenylcarbonyl)piperazin-1-ium-1-yl]ethanone

Systemtic Name: 1-(4-methoxyphenyl)-2-[4-(phenylcarbonyl)piperazin-1-ium-1-yl]ethanone Openeye Name: 2-(4-benzoylpiperazin-1-ium-1-yl)-1-(4-methoxyphenyl)ethanone CAS Name: 2-(4-benzoyl-1-piperazin-1-iumyl)-1-(4-methoxyphenyl)ethanone IUPAC Name: 2-(4-benzoylpiperazin-1-ium-1-yl)-1-(4-methoxyphenyl)ethanone Traditional Name: 2-(4-benzoylpiperazin-1-ium-1-yl)-1-(4-methoxyphenyl)ethanone Formula: C20H23N2O3+ MolecularWeight: 339.40822

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C20H22N2O3/c1-25-18-9-7-16(8-10-18)19(23)15-21-11-13-22(14-12-21)20(24)17-5-3-2-4-6-17/h2-10H,11-15H2,1H3/p+1