1-[3,5-bis(chloranyl)-4-methoxy-phenyl]piperazin-4-ium chloride

Systemtic Name: 1-[3,5-bis(chloranyl)-4-methoxy-phenyl]piperazin-4-ium chloride Openeye Name: 1-(3,5-dichloro-4-methoxy-phenyl)piperazin-4-ium chloride CAS Name: 1-(3,5-dichloro-4-methoxyphenyl)piperazin-4-ium chloride IUPAC Name: 1-(3,5-dichloro-4-methoxyphenyl)piperazin-4-ium chloride Traditional Name: 1-(3,5-dichloro-4-methoxy-phenyl)piperazin-4-ium chloride Formula: C11H15Cl3N2O MolecularWeight: 297.6086

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1Cl)N2CC[NH2+]CC2)Cl.[Cl-]

Isomeric SMILES

COC1=C(C=C(C=C1Cl)N2CC[NH2+]CC2)Cl.[Cl-]

InChI

InChI=1S/C11H14Cl2N2O.ClH/c1-16-11-9(12)6-8(7-10(11)13)15-4-2-14-3-5-15;/h6-7,14H,2-5H2,1H3;1H