ethanedioic acid; 4-(phenylmethyl)-1-[2-(2-phenylsulfanylethoxy)ethyl]piperidine

Systemtic Name: ethanedioic acid; 4-(phenylmethyl)-1-[2-(2-phenylsulfanylethoxy)ethyl]piperidine Openeye Name: 4-benzyl-1-[2-(2-phenylsulfanylethoxy)ethyl]piperidine; oxalic acid CAS Name: oxalic acid; 4-(phenylmethyl)-1-[2-[2-(phenylthio)ethoxy]ethyl]piperidine IUPAC Name: 4-benzyl-1-[2-(2-phenylsulfanylethoxy)ethyl]piperidine; oxalic acid Traditional Name: 4-benzyl-1-[2-[2-(phenylthio)ethoxy]ethyl]piperidine; oxalic acid Formula: C24H31NO5S MolecularWeight: 445.57164

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)CCOCCSC3=CC=CC=C3.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)CCOCCSC3=CC=CC=C3.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H29NOS.C2H2O4/c1-3-7-20(8-4-1)19-21-11-13-23(14-12-21)15-16-24-17-18-25-22-9-5-2-6-10-22;3-1(4)2(5)6/h1-10,21H,11-19H2;(H,3,4)(H,5,6)