1-(1,3-benzodioxol-5-ylmethyl)-4-propan-2-yl-piperazin-4-ium

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-propan-2-yl-piperazin-4-ium Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-isopropyl-piperazin-4-ium CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-propan-2-ylpiperazin-4-ium IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-propan-2-ylpiperazin-4-ium Traditional Name: 1-isopropyl-4-piperonyl-piperazin-1-ium Formula: C15H23N2O2+ MolecularWeight: 263.35532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCN(CC1)CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)[NH+]1CCN(CC1)CC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C15H22N2O2/c1-12(2)17-7-5-16(6-8-17)10-13-3-4-14-15(9-13)19-11-18-14/h3-4,9,12H,5-8,10-11H2,1-2H3/p+1