1-[3-(1,3-benzodioxol-5-yloxy)-3-phenyl-propyl]-4-(4-chlorophenyl)piperazine

Systemtic Name: 1-[3-(1,3-benzodioxol-5-yloxy)-3-phenyl-propyl]-4-(4-chlorophenyl)piperazine Openeye Name: 1-[3-(1,3-benzodioxol-5-yloxy)-3-phenyl-propyl]-4-(4-chlorophenyl)piperazine CAS Name: 1-[3-(1,3-benzodioxol-5-yloxy)-3-phenylpropyl]-4-(4-chlorophenyl)piperazine IUPAC Name: 1-[3-(1,3-benzodioxol-5-yloxy)-3-phenylpropyl]-4-(4-chlorophenyl)piperazine Traditional Name: 1-[3-(1,3-benzodioxol-5-yloxy)-3-phenyl-propyl]-4-(4-chlorophenyl)piperazine Formula: C26H27ClN2O3 MolecularWeight: 450.95718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(C2=CC=CC=C2)OC3=CC4=C(C=C3)OCO4)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1CN(CCN1CCC(C2=CC=CC=C2)OC3=CC4=C(C=C3)OCO4)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C26H27ClN2O3/c27-21-6-8-22(9-7-21)29-16-14-28(15-17-29)13-12-24(20-4-2-1-3-5-20)32-23-10-11-25-26(18-23)31-19-30-25/h1-11,18,24H,12-17,19H2