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

Systemtic Name: 1-[2-[2-(4-chlorophenyl)sulfanylethoxy]ethyl]-4-ethyl-piperazine; ethanedioic acid Openeye Name: 1-[2-[2-(4-chlorophenyl)sulfanylethoxy]ethyl]-4-ethyl-piperazine; oxalic acid CAS Name: 1-[2-[2-[(4-chlorophenyl)thio]ethoxy]ethyl]-4-ethylpiperazine; oxalic acid IUPAC Name: 1-[2-[2-(4-chlorophenyl)sulfanylethoxy]ethyl]-4-ethylpiperazine; oxalic acid Traditional Name: 1-[2-[2-[(4-chlorophenyl)thio]ethoxy]ethyl]-4-ethyl-piperazine; oxalic acid Formula: C18H27ClN2O5S MolecularWeight: 418.93538

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CCOCCSC2=CC=C(C=C2)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

CCN1CCN(CC1)CCOCCSC2=CC=C(C=C2)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C16H25ClN2OS.C2H2O4/c1-2-18-7-9-19(10-8-18)11-12-20-13-14-21-16-5-3-15(17)4-6-16;3-1(4)2(5)6/h3-6H,2,7-14H2,1H3;(H,3,4)(H,5,6)