1-[3,5-bis(chloranyl)pyridin-1-ium-2-yl]-4-(2-methylphenyl)piperazine

Systemtic Name: 1-[3,5-bis(chloranyl)pyridin-1-ium-2-yl]-4-(2-methylphenyl)piperazine Openeye Name: 1-(3,5-dichloropyridin-1-ium-2-yl)-4-(o-tolyl)piperazine CAS Name: 1-(3,5-dichloro-2-pyridin-1-iumyl)-4-(2-methylphenyl)piperazine IUPAC Name: 1-(3,5-dichloropyridin-1-ium-2-yl)-4-(2-methylphenyl)piperazine Traditional Name: 1-(3,5-dichloropyridin-1-ium-2-yl)-4-(o-tolyl)piperazine Formula: C16H18Cl2N3+ MolecularWeight: 323.24022

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)C3=C(C=C(C=[NH+]3)Cl)Cl

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)C3=C(C=C(C=[NH+]3)Cl)Cl

InChI

InChI=1S/C16H17Cl2N3/c1-12-4-2-3-5-15(12)20-6-8-21(9-7-20)16-14(18)10-13(17)11-19-16/h2-5,10-11H,6-9H2,1H3/p+1