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

Systemtic Name: 1-[2-(chloromethyl)phenyl]-4-ethyl-piperazin-4-ium Openeye Name: 1-[2-(chloromethyl)phenyl]-4-ethyl-piperazin-4-ium CAS Name: 1-[2-(chloromethyl)phenyl]-4-ethylpiperazin-4-ium IUPAC Name: 1-[2-(chloromethyl)phenyl]-4-ethylpiperazin-4-ium Traditional Name: 1-[2-(chloromethyl)phenyl]-4-ethyl-piperazin-4-ium Formula: C13H20ClN2+ MolecularWeight: 239.7643

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=CC=CC=C2CCl

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=CC=CC=C2CCl

InChI

InChI=1S/C13H19ClN2/c1-2-15-7-9-16(10-8-15)13-6-4-3-5-12(13)11-14/h3-6H,2,7-11H2,1H3/p+1