6-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]pyridin-1-ium-3-amine

Systemtic Name: 6-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]pyridin-1-ium-3-amine Openeye Name: 6-[4-(5-chloro-2-methyl-phenyl)piperazin-1-yl]pyridin-1-ium-3-amine CAS Name: 6-[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-3-pyridin-1-iumamine IUPAC Name: 6-[4-(5-chloro-2-methylphenyl)piperazin-1-yl]pyridin-1-ium-3-amine Traditional Name: [6-[4-(5-chloro-2-methyl-phenyl)piperazino]pyridin-1-ium-3-yl]amine Formula: C16H20ClN4+ MolecularWeight: 303.8098

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C3=[NH+]C=C(C=C3)N

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C3=[NH+]C=C(C=C3)N

InChI

InChI=1S/C16H19ClN4/c1-12-2-3-13(17)10-15(12)20-6-8-21(9-7-20)16-5-4-14(18)11-19-16/h2-5,10-11H,6-9,18H2,1H3/p+1