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

Systemtic Name: 1-[3-chloranyl-2-(chloromethyl)phenyl]-4-methyl-piperazin-4-ium Openeye Name: 1-[3-chloro-2-(chloromethyl)phenyl]-4-methyl-piperazin-4-ium CAS Name: 1-[3-chloro-2-(chloromethyl)phenyl]-4-methylpiperazin-4-ium IUPAC Name: 1-[3-chloro-2-(chloromethyl)phenyl]-4-methylpiperazin-4-ium Traditional Name: 1-[3-chloro-2-(chloromethyl)phenyl]-4-methyl-piperazin-4-ium Formula: C12H17Cl2N2+ MolecularWeight: 260.18278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H16Cl2N2/c1-15-5-7-16(8-6-15)12-4-2-3-11(14)10(12)9-13/h2-4H,5-9H2,1H3/p+1