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

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(2-nitrophenyl)ethanamide Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(2-nitrophenyl)acetamide CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-N-(2-nitrophenyl)acetamide IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(2-nitrophenyl)acetamide Traditional Name: N-(2-nitrophenyl)-2-(4-piperonylpiperazino)acetamide Formula: C20H22N4O5 MolecularWeight: 398.41248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC(=O)NC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC(=O)NC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O5/c25-20(21-16-3-1-2-4-17(16)24(26)27)13-23-9-7-22(8-10-23)12-15-5-6-18-19(11-15)29-14-28-18/h1-6,11H,7-10,12-14H2,(H,21,25)