1-[2-[2-(4-chlorophenyl)sulfanylethoxy]ethyl]-4-methyl-piperazine; ethanedioic acid

Systemtic Name: 1-[2-[2-(4-chlorophenyl)sulfanylethoxy]ethyl]-4-methyl-piperazine; ethanedioic acid Openeye Name: 1-[2-[2-(4-chlorophenyl)sulfanylethoxy]ethyl]-4-methyl-piperazine; oxalic acid CAS Name: 1-[2-[2-[(4-chlorophenyl)thio]ethoxy]ethyl]-4-methylpiperazine; oxalic acid IUPAC Name: 1-[2-[2-(4-chlorophenyl)sulfanylethoxy]ethyl]-4-methylpiperazine; oxalic acid Traditional Name: 1-[2-[2-[(4-chlorophenyl)thio]ethoxy]ethyl]-4-methyl-piperazine; oxalic acid Formula: C17H25ClN2O5S MolecularWeight: 404.9088

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCOCCSC2=CC=C(C=C2)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

CN1CCN(CC1)CCOCCSC2=CC=C(C=C2)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C15H23ClN2OS.C2H2O4/c1-17-6-8-18(9-7-17)10-11-19-12-13-20-15-4-2-14(16)3-5-15;3-1(4)2(5)6/h2-5H,6-13H2,1H3;(H,3,4)(H,5,6)