2-[4-[(3,4-dimethoxyphenyl)methyl]piperazine-1,4-diium-1-yl]-N-(3-methoxyphenyl)ethanamide

Systemtic Name: 2-[4-[(3,4-dimethoxyphenyl)methyl]piperazine-1,4-diium-1-yl]-N-(3-methoxyphenyl)ethanamide Openeye Name: 2-[4-[(3,4-dimethoxyphenyl)methyl]piperazine-1,4-diium-1-yl]-N-(3-methoxyphenyl)acetamide CAS Name: 2-[4-[(3,4-dimethoxyphenyl)methyl]-1-piperazine-1,4-diiumyl]-N-(3-methoxyphenyl)acetamide IUPAC Name: 2-[4-[(3,4-dimethoxyphenyl)methyl]piperazine-1,4-diium-1-yl]-N-(3-methoxyphenyl)acetamide Traditional Name: N-(3-methoxyphenyl)-2-(4-veratrylpiperazine-1,4-diium-1-yl)acetamide Formula: C22H31N3O4+2 MolecularWeight: 401.49924

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C[NH+]2CC[NH+](CC2)CC(=O)NC3=CC(=CC=C3)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C[NH+]2CC[NH+](CC2)CC(=O)NC3=CC(=CC=C3)OC)OC

InChI

InChI=1S/C22H29N3O4/c1-27-19-6-4-5-18(14-19)23-22(26)16-25-11-9-24(10-12-25)15-17-7-8-20(28-2)21(13-17)29-3/h4-8,13-14H,9-12,15-16H2,1-3H3,(H,23,26)/p+2