1-[4-ethoxy-3-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]phenyl]ethanone

Systemtic Name: 1-[4-ethoxy-3-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]phenyl]ethanone Openeye Name: 1-[4-ethoxy-3-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]phenyl]ethanone CAS Name: 1-[4-ethoxy-3-[[4-(4-methoxyphenyl)-1-piperazin-1-iumyl]methyl]phenyl]ethanone IUPAC Name: 1-[4-ethoxy-3-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]phenyl]ethanone Traditional Name: 1-[4-ethoxy-3-[[4-(4-methoxyphenyl)piperazin-1-ium-1-yl]methyl]phenyl]ethanone Formula: C22H29N2O3+ MolecularWeight: 369.47726

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)C)C[NH+]2CCN(CC2)C3=CC=C(C=C3)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)C)C[NH+]2CCN(CC2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H28N2O3/c1-4-27-22-10-5-18(17(2)25)15-19(22)16-23-11-13-24(14-12-23)20-6-8-21(26-3)9-7-20/h5-10,15H,4,11-14,16H2,1-3H3/p+1