1-(1,3-benzodioxol-5-ylmethyl)-4-[[1-(2-chloranylpyridin-3-yl)pyrrol-2-yl]methyl]piperazine

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[[1-(2-chloranylpyridin-3-yl)pyrrol-2-yl]methyl]piperazine Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[[1-(2-chloro-3-pyridyl)pyrrol-2-yl]methyl]piperazine CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[[1-(2-chloro-3-pyridinyl)-2-pyrrolyl]methyl]piperazine IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[[1-(2-chloropyridin-3-yl)pyrrol-2-yl]methyl]piperazine Traditional Name: 1-[[1-(2-chloro-3-pyridyl)pyrrol-2-yl]methyl]-4-piperonyl-piperazine Formula: C22H23ClN4O2 MolecularWeight: 410.89662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC4=CC=CN4C5=C(N=CC=C5)Cl

Isomeric SMILES

C1CN(CCN1CC2=CC3=C(C=C2)OCO3)CC4=CC=CN4C5=C(N=CC=C5)Cl

InChI

InChI=1S/C22H23ClN4O2/c23-22-19(4-1-7-24-22)27-8-2-3-18(27)15-26-11-9-25(10-12-26)14-17-5-6-20-21(13-17)29-16-28-20/h1-8,13H,9-12,14-16H2