1-[3-(1,3-benzodioxol-4-yloxy)-3-thiophen-2-yl-propyl]piperidine; ethanedioic acid

Systemtic Name: 1-[3-(1,3-benzodioxol-4-yloxy)-3-thiophen-2-yl-propyl]piperidine; ethanedioic acid Openeye Name: 1-[3-(1,3-benzodioxol-4-yloxy)-3-(2-thienyl)propyl]piperidine; oxalic acid CAS Name: 1-[3-(1,3-benzodioxol-4-yloxy)-3-thiophen-2-ylpropyl]piperidine; oxalic acid IUPAC Name: 1-[3-(1,3-benzodioxol-4-yloxy)-3-thiophen-2-ylpropyl]piperidine; oxalic acid Traditional Name: 1-[3-(1,3-benzodioxol-4-yloxy)-3-(2-thienyl)propyl]piperidine; oxalic acid Formula: C21H25NO7S MolecularWeight: 435.4907

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCC(C2=CC=CS2)OC3=CC=CC4=C3OCO4.C(=O)(C(=O)O)O

Isomeric SMILES

C1CCN(CC1)CCC(C2=CC=CS2)OC3=CC=CC4=C3OCO4.C(=O)(C(=O)O)O

InChI

InChI=1S/C19H23NO3S.C2H2O4/c1-2-10-20(11-3-1)12-9-15(18-8-5-13-24-18)23-17-7-4-6-16-19(17)22-14-21-16;3-1(4)2(5)6/h4-8,13,15H,1-3,9-12,14H2;(H,3,4)(H,5,6)