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

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(4-chloranyl-2-methoxy-5-methyl-phenyl)ethanamide Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(4-chloro-2-methoxy-5-methyl-phenyl)acetamide CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-N-(4-chloro-2-methoxy-5-methylphenyl)acetamide IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(4-chloro-2-methoxy-5-methylphenyl)acetamide Traditional Name: N-(4-chloro-2-methoxy-5-methyl-phenyl)-2-(4-piperonylpiperazino)acetamide Formula: C22H26ClN3O4 MolecularWeight: 431.91254

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1Cl)OC)NC(=O)CN2CCN(CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC(=C(C=C1Cl)OC)NC(=O)CN2CCN(CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H26ClN3O4/c1-15-9-18(20(28-2)11-17(15)23)24-22(27)13-26-7-5-25(6-8-26)12-16-3-4-19-21(10-16)30-14-29-19/h3-4,9-11H,5-8,12-14H2,1-2H3,(H,24,27)