1-[(3,4-dimethoxyphenyl)methyl]-4-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperazine-1,4-diium

Systemtic Name: 1-[(3,4-dimethoxyphenyl)methyl]-4-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperazine-1,4-diium Openeye Name: 1-[(3,4-dimethoxyphenyl)methyl]-4-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperazine-1,4-diium CAS Name: 1-[(3,4-dimethoxyphenyl)methyl]-4-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperazine-1,4-diium IUPAC Name: 1-[(3,4-dimethoxyphenyl)methyl]-4-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperazine-1,4-diium Traditional Name: 1-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-4-veratryl-piperazine-1,4-diium Formula: C22H30N2O5+2 MolecularWeight: 402.484

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C[NH+]2CC[NH+](CC2)CC3=CC4=C(C(=C3)OC)OCO4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C[NH+]2CC[NH+](CC2)CC3=CC4=C(C(=C3)OC)OCO4)OC

InChI

InChI=1S/C22H28N2O5/c1-25-18-5-4-16(10-19(18)26-2)13-23-6-8-24(9-7-23)14-17-11-20(27-3)22-21(12-17)28-15-29-22/h4-5,10-12H,6-9,13-15H2,1-3H3/p+2