2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(4-chloranyl-2,5-dimethoxy-phenyl)ethanamide

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(4-chloranyl-2,5-dimethoxy-phenyl)ethanamide Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(4-chloro-2,5-dimethoxy-phenyl)acetamide CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-N-(4-chloro-2,5-dimethoxyphenyl)acetamide IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(4-chloro-2,5-dimethoxyphenyl)acetamide Traditional Name: N-(4-chloro-2,5-dimethoxy-phenyl)-2-(4-piperonylpiperazino)acetamide Formula: C22H26ClN3O5 MolecularWeight: 447.91194

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC(=O)CN2CCN(CC2)CC3=CC4=C(C=C3)OCO4)OC)Cl

Isomeric SMILES

COC1=CC(=C(C=C1NC(=O)CN2CCN(CC2)CC3=CC4=C(C=C3)OCO4)OC)Cl

InChI

InChI=1S/C22H26ClN3O5/c1-28-19-11-17(20(29-2)10-16(19)23)24-22(27)13-26-7-5-25(6-8-26)12-15-3-4-18-21(9-15)31-14-30-18/h3-4,9-11H,5-8,12-14H2,1-2H3,(H,24,27)