1-[2-[2-(4-chlorophenyl)sulfanylethoxy]ethyl]-4-ethyl-piperazin-4-ium

Systemtic Name: 1-[2-[2-(4-chlorophenyl)sulfanylethoxy]ethyl]-4-ethyl-piperazin-4-ium Openeye Name: 1-[2-[2-(4-chlorophenyl)sulfanylethoxy]ethyl]-4-ethyl-piperazin-4-ium CAS Name: 1-[2-[2-[(4-chlorophenyl)thio]ethoxy]ethyl]-4-ethylpiperazin-4-ium IUPAC Name: 1-[2-[2-(4-chlorophenyl)sulfanylethoxy]ethyl]-4-ethylpiperazin-4-ium Traditional Name: 1-[2-[2-[(4-chlorophenyl)thio]ethoxy]ethyl]-4-ethyl-piperazin-4-ium Formula: C16H26ClN2OS+ MolecularWeight: 329.90844

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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