1-[3-[2-(1-benzothiophen-5-yl)ethoxy]propyl]-3-phenylmethoxy-azetidine; ethanedioic acid

Systemtic Name: 1-[3-[2-(1-benzothiophen-5-yl)ethoxy]propyl]-3-phenylmethoxy-azetidine; ethanedioic acid Openeye Name: 1-[3-[2-(benzothiophen-5-yl)ethoxy]propyl]-3-benzyloxy-azetidine; oxalic acid CAS Name: 1-[3-[2-(1-benzothiophen-5-yl)ethoxy]propyl]-3-phenylmethoxyazetidine; oxalic acid IUPAC Name: 1-[3-[2-(1-benzothiophen-5-yl)ethoxy]propyl]-3-phenylmethoxyazetidine; oxalic acid Traditional Name: 1-[3-[2-(benzothiophen-5-yl)ethoxy]propyl]-3-benzoxy-azetidine; oxalic acid Formula: C25H29NO6S MolecularWeight: 471.56586

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN1CCCOCCC2=CC3=C(C=C2)SC=C3)OCC4=CC=CC=C4.C(=O)(C(=O)O)O

Isomeric SMILES

C1C(CN1CCCOCCC2=CC3=C(C=C2)SC=C3)OCC4=CC=CC=C4.C(=O)(C(=O)O)O

InChI

InChI=1S/C23H27NO2S.C2H2O4/c1-2-5-20(6-3-1)18-26-22-16-24(17-22)11-4-12-25-13-9-19-7-8-23-21(15-19)10-14-27-23;3-1(4)2(5)6/h1-3,5-8,10,14-15,22H,4,9,11-13,16-18H2;(H,3,4)(H,5,6)