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

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N,N-diethyl-ethanamide Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N,N-diethyl-acetamide CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-N,N-diethylacetamide IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N,N-diethylacetamide Traditional Name: N,N-diethyl-2-(4-piperonylpiperazino)acetamide Formula: C18H27N3O3 MolecularWeight: 333.42528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CN1CCN(CC1)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCN(CC)C(=O)CN1CCN(CC1)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H27N3O3/c1-3-21(4-2)18(22)13-20-9-7-19(8-10-20)12-15-5-6-16-17(11-15)24-14-23-16/h5-6,11H,3-4,7-10,12-14H2,1-2H3