(5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl 5-bromanyl-2-chloranyl-benzoate

Systemtic Name: (5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl 5-bromanyl-2-chloranyl-benzoate Openeye Name: (5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl 5-bromo-2-chloro-benzoate CAS Name: 5-bromo-2-chlorobenzoic acid (5,7-dimethyl-2-imidazo[1,2-a]pyrimidinyl)methyl ester IUPAC Name: (5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl 5-bromo-2-chlorobenzoate Traditional Name: 5-bromo-2-chloro-benzoic acid (5,7-dimethylimidazo[1,2-a]pyrimidin-2-yl)methyl ester Formula: C16H13BrClN3O2 MolecularWeight: 394.65032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=NC(=CN12)COC(=O)C3=C(C=CC(=C3)Br)Cl)C

Isomeric SMILES

CC1=CC(=NC2=NC(=CN12)COC(=O)C3=C(C=CC(=C3)Br)Cl)C

InChI

InChI=1S/C16H13BrClN3O2/c1-9-5-10(2)21-7-12(20-16(21)19-9)8-23-15(22)13-6-11(17)3-4-14(13)18/h3-7H,8H2,1-2H3