1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]nonan-1-one

Systemtic Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]nonan-1-one Openeye Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]nonan-1-one CAS Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-1-nonanone IUPAC Name: 1-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]nonan-1-one Traditional Name: 1-(4-piperonylpiperazino)nonan-1-one Formula: C21H32N2O3 MolecularWeight: 360.49038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(=O)N1CCN(CC1)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCCCCCCCC(=O)N1CCN(CC1)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C21H32N2O3/c1-2-3-4-5-6-7-8-21(24)23-13-11-22(12-14-23)16-18-9-10-19-20(15-18)26-17-25-19/h9-10,15H,2-8,11-14,16-17H2,1H3