N5-(3-bromanyl-4-methyl-phenyl)pyridin-1-ium-2,5-diamine

Systemtic Name: N5-(3-bromanyl-4-methyl-phenyl)pyridin-1-ium-2,5-diamine Openeye Name: N5-(3-bromo-4-methyl-phenyl)pyridin-1-ium-2,5-diamine CAS Name: N5-(3-bromo-4-methylphenyl)pyridin-1-ium-2,5-diamine IUPAC Name: 5-N-(3-bromo-4-methylphenyl)pyridin-1-ium-2,5-diamine Traditional Name: (6-aminopyridin-1-ium-3-yl)-(3-bromo-4-methyl-phenyl)amine Formula: C12H13BrN3+ MolecularWeight: 279.15572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC2=C[NH+]=C(C=C2)N)Br

Isomeric SMILES

CC1=C(C=C(C=C1)NC2=C[NH+]=C(C=C2)N)Br

InChI

InChI=1S/C12H12BrN3/c1-8-2-3-9(6-11(8)13)16-10-4-5-12(14)15-7-10/h2-7,16H,1H3,(H2,14,15)/p+1