2-[(4-chlorophenyl)methylsulfanyl]-3-(2-methoxyethoxy)-1-pentyl-piperidine; ethanedioic acid

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-3-(2-methoxyethoxy)-1-pentyl-piperidine; ethanedioic acid Openeye Name: 2-[(4-chlorophenyl)methylsulfanyl]-3-(2-methoxyethoxy)-1-pentyl-piperidine; oxalic acid CAS Name: 2-[(4-chlorophenyl)methylthio]-3-(2-methoxyethoxy)-1-pentylpiperidine; oxalic acid IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-3-(2-methoxyethoxy)-1-pentylpiperidine; oxalic acid Traditional Name: 1-amyl-2-[(4-chlorobenzyl)thio]-3-(2-methoxyethoxy)piperidine; oxalic acid Formula: C22H34ClNO6S MolecularWeight: 476.02646

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1CCCC(C1SCC2=CC=C(C=C2)Cl)OCCOC.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCCN1CCCC(C1SCC2=CC=C(C=C2)Cl)OCCOC.C(=O)(C(=O)O)O

InChI

InChI=1S/C20H32ClNO2S.C2H2O4/c1-3-4-5-12-22-13-6-7-19(24-15-14-23-2)20(22)25-16-17-8-10-18(21)11-9-17;3-1(4)2(5)6/h8-11,19-20H,3-7,12-16H2,1-2H3;(H,3,4)(H,5,6)