1-[2-(2,6-dimethoxyphenoxy)ethyl]-4-(2-methoxyphenyl)piperazin-1-ium chloride

Systemtic Name: 1-[2-(2,6-dimethoxyphenoxy)ethyl]-4-(2-methoxyphenyl)piperazin-1-ium chloride Openeye Name: 1-[2-(2,6-dimethoxyphenoxy)ethyl]-4-(2-methoxyphenyl)piperazin-1-ium chloride CAS Name: 1-[2-(2,6-dimethoxyphenoxy)ethyl]-4-(2-methoxyphenyl)piperazin-1-ium chloride IUPAC Name: 1-[2-(2,6-dimethoxyphenoxy)ethyl]-4-(2-methoxyphenyl)piperazin-1-ium chloride Traditional Name: 1-[2-(2,6-dimethoxyphenoxy)ethyl]-4-(2-methoxyphenyl)piperazin-1-ium chloride Formula: C21H29ClN2O4 MolecularWeight: 408.91896

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC=C1)OC)OCC[NH+]2CCN(CC2)C3=CC=CC=C3OC.[Cl-]

Isomeric SMILES

COC1=C(C(=CC=C1)OC)OCC[NH+]2CCN(CC2)C3=CC=CC=C3OC.[Cl-]

InChI

InChI=1S/C21H28N2O4.ClH/c1-24-18-8-5-4-7-17(18)23-13-11-22(12-14-23)15-16-27-21-19(25-2)9-6-10-20(21)26-3;/h4-10H,11-16H2,1-3H3;1H