1-[3-(1,3-benzodioxol-5-yloxy)-3-thiophen-3-yl-propyl]-4-(2-methoxyphenyl)piperazine

Systemtic Name: 1-[3-(1,3-benzodioxol-5-yloxy)-3-thiophen-3-yl-propyl]-4-(2-methoxyphenyl)piperazine Openeye Name: 1-[3-(1,3-benzodioxol-5-yloxy)-3-(3-thienyl)propyl]-4-(2-methoxyphenyl)piperazine CAS Name: 1-[3-(1,3-benzodioxol-5-yloxy)-3-(3-thiophenyl)propyl]-4-(2-methoxyphenyl)piperazine IUPAC Name: 1-[3-(1,3-benzodioxol-5-yloxy)-3-thiophen-3-ylpropyl]-4-(2-methoxyphenyl)piperazine Traditional Name: 1-[3-(1,3-benzodioxol-5-yloxy)-3-(3-thienyl)propyl]-4-(2-methoxyphenyl)piperazine Formula: C25H28N2O4S MolecularWeight: 452.56582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CCC(C3=CSC=C3)OC4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CCC(C3=CSC=C3)OC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H28N2O4S/c1-28-23-5-3-2-4-21(23)27-13-11-26(12-14-27)10-8-22(19-9-15-32-17-19)31-20-6-7-24-25(16-20)30-18-29-24/h2-7,9,15-17,22H,8,10-14,18H2,1H3