2-[4-[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]-N-(2-methoxyphenyl)ethanamide

Systemtic Name: 2-[4-[2-(1,3-benzodioxol-5-yl)-2-oxidanylidene-ethyl]piperazin-1-yl]-N-(2-methoxyphenyl)ethanamide Openeye Name: 2-[4-[2-(1,3-benzodioxol-5-yl)-2-oxo-ethyl]piperazin-1-yl]-N-(2-methoxyphenyl)acetamide CAS Name: 2-[4-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]-1-piperazinyl]-N-(2-methoxyphenyl)acetamide IUPAC Name: 2-[4-[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]piperazin-1-yl]-N-(2-methoxyphenyl)acetamide Traditional Name: 2-[4-[2-(1,3-benzodioxol-5-yl)-2-keto-ethyl]piperazino]-N-(2-methoxyphenyl)acetamide Formula: C22H25N3O5 MolecularWeight: 411.451

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25N3O5/c1-28-19-5-3-2-4-17(19)23-22(27)14-25-10-8-24(9-11-25)13-18(26)16-6-7-20-21(12-16)30-15-29-20/h2-7,12H,8-11,13-15H2,1H3,(H,23,27)