1-(1,3-benzodioxol-5-ylmethyl)-4-[3-(2-methoxy-4-methyl-phenoxy)-3-thiophen-2-yl-propyl]piperazine

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[3-(2-methoxy-4-methyl-phenoxy)-3-thiophen-2-yl-propyl]piperazine Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[3-(2-methoxy-4-methyl-phenoxy)-3-(2-thienyl)propyl]piperazine CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[3-(2-methoxy-4-methylphenoxy)-3-thiophen-2-ylpropyl]piperazine IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-4-[3-(2-methoxy-4-methylphenoxy)-3-thiophen-2-ylpropyl]piperazine Traditional Name: 1-[3-(2-methoxy-4-methyl-phenoxy)-3-(2-thienyl)propyl]-4-piperonyl-piperazine Formula: C27H32N2O4S MolecularWeight: 480.61898

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(CCN2CCN(CC2)CC3=CC4=C(C=C3)OCO4)C5=CC=CS5)OC

Isomeric SMILES

CC1=CC(=C(C=C1)OC(CCN2CCN(CC2)CC3=CC4=C(C=C3)OCO4)C5=CC=CS5)OC

InChI

InChI=1S/C27H32N2O4S/c1-20-5-7-23(25(16-20)30-2)33-24(27-4-3-15-34-27)9-10-28-11-13-29(14-12-28)18-21-6-8-22-26(17-21)32-19-31-22/h3-8,15-17,24H,9-14,18-19H2,1-2H3