1-(1,3-benzodioxol-5-ylmethyl)-4-(3-phenylprop-2-ynyl)piperazine

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(3-phenylprop-2-ynyl)piperazine Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(3-phenylprop-2-ynyl)piperazine CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(3-phenylprop-2-ynyl)piperazine IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-(3-phenylprop-2-ynyl)piperazine Traditional Name: 1-(3-phenylprop-2-ynyl)-4-piperonyl-piperazine Formula: C21H22N2O2 MolecularWeight: 334.41158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC#CC2=CC=CC=C2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CN(CCN1CC#CC2=CC=CC=C2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H22N2O2/c1-2-5-18(6-3-1)7-4-10-22-11-13-23(14-12-22)16-19-8-9-20-21(15-19)25-17-24-20/h1-3,5-6,8-9,15H,10-14,16-17H2