1-[3-chloranyl-2-(chloromethyl)phenyl]-4-ethyl-piperazin-4-ium

Systemtic Name: 1-[3-chloranyl-2-(chloromethyl)phenyl]-4-ethyl-piperazin-4-ium Openeye Name: 1-[3-chloro-2-(chloromethyl)phenyl]-4-ethyl-piperazin-4-ium CAS Name: 1-[3-chloro-2-(chloromethyl)phenyl]-4-ethylpiperazin-4-ium IUPAC Name: 1-[3-chloro-2-(chloromethyl)phenyl]-4-ethylpiperazin-4-ium Traditional Name: 1-[3-chloro-2-(chloromethyl)phenyl]-4-ethyl-piperazin-4-ium Formula: C13H19Cl2N2+ MolecularWeight: 274.20936

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H18Cl2N2/c1-2-16-6-8-17(9-7-16)13-5-3-4-12(15)11(13)10-14/h3-5H,2,6-10H2,1H3/p+1