1-[3-(4-chlorophenyl)sulfanylpropyl]piperazine; ethanedioic acid

Systemtic Name: 1-[3-(4-chlorophenyl)sulfanylpropyl]piperazine; ethanedioic acid Openeye Name: 1-[3-(4-chlorophenyl)sulfanylpropyl]piperazine; oxalic acid CAS Name: 1-[3-[(4-chlorophenyl)thio]propyl]piperazine; oxalic acid IUPAC Name: 1-[3-(4-chlorophenyl)sulfanylpropyl]piperazine; oxalic acid Traditional Name: 1-[3-[(4-chlorophenyl)thio]propyl]piperazine; oxalic acid Formula: C15H21ClN2O4S MolecularWeight: 360.85624

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CCCSC2=CC=C(C=C2)Cl.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN(CCN1)CCCSC2=CC=C(C=C2)Cl.C(=O)(C(=O)O)O

InChI

InChI=1S/C13H19ClN2S.C2H2O4/c14-12-2-4-13(5-3-12)17-11-1-8-16-9-6-15-7-10-16;3-1(4)2(5)6/h2-5,15H,1,6-11H2;(H,3,4)(H,5,6)