(2-chloranyl-4-iodanyl-phenyl)methyl 2,7-dimethyl-1H-imidazo[4,5-b]pyridine-5-carboxylate

Systemtic Name: (2-chloranyl-4-iodanyl-phenyl)methyl 2,7-dimethyl-1H-imidazo[4,5-b]pyridine-5-carboxylate Openeye Name: (2-chloro-4-iodo-phenyl)methyl 2,7-dimethyl-1H-imidazo[4,5-b]pyridine-5-carboxylate CAS Name: 2,7-dimethyl-1H-imidazo[4,5-b]pyridine-5-carboxylic acid (2-chloro-4-iodophenyl)methyl ester IUPAC Name: (2-chloro-4-iodophenyl)methyl 2,7-dimethyl-1H-imidazo[4,5-b]pyridine-5-carboxylate Traditional Name: 2,7-dimethyl-1H-imidazo[4,5-b]pyridine-5-carboxylic acid (2-chloro-4-iodo-benzyl) ester Formula: C16H13ClIN3O2 MolecularWeight: 441.65079

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1NC(=N2)C)C(=O)OCC3=C(C=C(C=C3)I)Cl

Isomeric SMILES

CC1=CC(=NC2=C1NC(=N2)C)C(=O)OCC3=C(C=C(C=C3)I)Cl

InChI

InChI=1S/C16H13ClIN3O2/c1-8-5-13(21-15-14(8)19-9(2)20-15)16(22)23-7-10-3-4-11(18)6-12(10)17/h3-6H,7H2,1-2H3,(H,19,20,21)