N-(1,3-benzodioxol-5-yl)-2-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]ethanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]acetamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-[4-[(3,4-dimethoxyphenyl)methyl]-1-piperazinyl]acetamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]acetamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-(4-veratrylpiperazino)acetamide Formula: C22H27N3O5 MolecularWeight: 413.46688

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2CCN(CC2)CC(=O)NC3=CC4=C(C=C3)OCO4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN2CCN(CC2)CC(=O)NC3=CC4=C(C=C3)OCO4)OC

InChI

InChI=1S/C22H27N3O5/c1-27-18-5-3-16(11-20(18)28-2)13-24-7-9-25(10-8-24)14-22(26)23-17-4-6-19-21(12-17)30-15-29-19/h3-6,11-12H,7-10,13-15H2,1-2H3,(H,23,26)