1-[2-[2-(4-chlorophenyl)sulfanylethoxy]ethyl]-4-methyl-piperazine-1,4-diium

Systemtic Name: 1-[2-[2-(4-chlorophenyl)sulfanylethoxy]ethyl]-4-methyl-piperazine-1,4-diium Openeye Name: 1-[2-[2-(4-chlorophenyl)sulfanylethoxy]ethyl]-4-methyl-piperazine-1,4-diium CAS Name: 1-[2-[2-[(4-chlorophenyl)thio]ethoxy]ethyl]-4-methylpiperazine-1,4-diium IUPAC Name: 1-[2-[2-(4-chlorophenyl)sulfanylethoxy]ethyl]-4-methylpiperazine-1,4-diium Traditional Name: 1-[2-[2-[(4-chlorophenyl)thio]ethoxy]ethyl]-4-methyl-piperazine-1,4-diium Formula: C15H25ClN2OS+2 MolecularWeight: 316.8898

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CCOCCSC2=CC=C(C=C2)Cl

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CCOCCSC2=CC=C(C=C2)Cl

InChI

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