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

Systemtic Name: 2-[4-[(3,4-dimethoxyphenyl)methyl]piperazine-1,4-diium-1-yl]-N-(2-methoxyphenyl)ethanamide Openeye Name: 2-[4-[(3,4-dimethoxyphenyl)methyl]piperazine-1,4-diium-1-yl]-N-(2-methoxyphenyl)acetamide CAS Name: 2-[4-[(3,4-dimethoxyphenyl)methyl]-1-piperazine-1,4-diiumyl]-N-(2-methoxyphenyl)acetamide IUPAC Name: 2-[4-[(3,4-dimethoxyphenyl)methyl]piperazine-1,4-diium-1-yl]-N-(2-methoxyphenyl)acetamide Traditional Name: N-(2-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=C3OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C[NH+]2CC[NH+](CC2)CC(=O)NC3=CC=CC=C3OC)OC

InChI

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