1,4-bis[(2,4-dimethoxyphenyl)methyl]piperazin-1-ium

Systemtic Name: 1,4-bis[(2,4-dimethoxyphenyl)methyl]piperazin-1-ium Openeye Name: 1,4-bis[(2,4-dimethoxyphenyl)methyl]piperazin-1-ium CAS Name: 1,4-bis[(2,4-dimethoxyphenyl)methyl]piperazin-1-ium IUPAC Name: 1,4-bis[(2,4-dimethoxyphenyl)methyl]piperazin-1-ium Traditional Name: 1,4-bis(2,4-dimethoxybenzyl)piperazin-1-ium Formula: C22H31N2O4+ MolecularWeight: 387.49254

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C[NH+]2CCN(CC2)CC3=C(C=C(C=C3)OC)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C[NH+]2CCN(CC2)CC3=C(C=C(C=C3)OC)OC)OC

InChI

InChI=1S/C22H30N2O4/c1-25-19-7-5-17(21(13-19)27-3)15-23-9-11-24(12-10-23)16-18-6-8-20(26-2)14-22(18)28-4/h5-8,13-14H,9-12,15-16H2,1-4H3/p+1