1-(1,3-benzodioxol-5-ylmethyl)-4-(1-propylsulfonylpiperidin-3-yl)piperazine

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(1-propylsulfonylpiperidin-3-yl)piperazine Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(1-propylsulfonyl-3-piperidyl)piperazine CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(1-propylsulfonyl-3-piperidinyl)piperazine IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(1-propylsulfonylpiperidin-3-yl)piperazine Traditional Name: 1-piperonyl-4-(1-propylsulfonyl-3-piperidyl)piperazine Formula: C20H31N3O4S MolecularWeight: 409.54284

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CCCC(C1)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCS(=O)(=O)N1CCCC(C1)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H31N3O4S/c1-2-12-28(24,25)23-7-3-4-18(15-23)22-10-8-21(9-11-22)14-17-5-6-19-20(13-17)27-16-26-19/h5-6,13,18H,2-4,7-12,14-16H2,1H3