1-[2-(4-nitrophenyl)sulfanylethyl]piperazine dihydrochloride

Systemtic Name: 1-[2-(4-nitrophenyl)sulfanylethyl]piperazine dihydrochloride Openeye Name: 1-[2-(4-nitrophenyl)sulfanylethyl]piperazine dihydrochloride CAS Name: 1-[2-[(4-nitrophenyl)thio]ethyl]piperazine dihydrochloride IUPAC Name: 1-[2-(4-nitrophenyl)sulfanylethyl]piperazine dihydrochloride Traditional Name: 1-[2-[(4-nitrophenyl)thio]ethyl]piperazine dihydrochloride Formula: C12H19Cl2N3O2S MolecularWeight: 340.26916

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CCSC2=CC=C(C=C2)[N+](=O)[O-].Cl.Cl

Isomeric SMILES

C1CN(CCN1)CCSC2=CC=C(C=C2)[N+](=O)[O-].Cl.Cl

InChI

InChI=1S/C12H17N3O2S.2ClH/c16-15(17)11-1-3-12(4-2-11)18-10-9-14-7-5-13-6-8-14;;/h1-4,13H,5-10H2;2*1H