5-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrimidin-1-ium-2,4-diamine

Systemtic Name: 5-[(2-chloranyl-6-fluoranyl-phenyl)methyl]pyrimidin-1-ium-2,4-diamine Openeye Name: 5-[(2-chloro-6-fluoro-phenyl)methyl]pyrimidin-1-ium-2,4-diamine CAS Name: 5-[(2-chloro-6-fluorophenyl)methyl]pyrimidin-1-ium-2,4-diamine IUPAC Name: 5-[(2-chloro-6-fluorophenyl)methyl]pyrimidin-1-ium-2,4-diamine Traditional Name: [2-amino-5-(2-chloro-6-fluoro-benzyl)pyrimidin-1-ium-4-yl]amine Formula: C11H11ClFN4+ MolecularWeight: 253.683243

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)CC2=C[NH+]=C(N=C2N)N)F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)CC2=C[NH+]=C(N=C2N)N)F

InChI

InChI=1S/C11H10ClFN4/c12-8-2-1-3-9(13)7(8)4-6-5-16-11(15)17-10(6)14/h1-3,5H,4H2,(H4,14,15,16,17)/p+1