methyl 3-iodanyl-1H-pyrrolo[2,3-b]pyridine-5-carboxylate

Systemtic Name: methyl 3-iodanyl-1H-pyrrolo[2,3-b]pyridine-5-carboxylate Openeye Name: methyl 3-iodo-1H-pyrrolo[2,3-b]pyridine-5-carboxylate CAS Name: 3-iodo-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid methyl ester IUPAC Name: methyl 3-iodo-1H-pyrrolo[2,3-b]pyridine-5-carboxylate Traditional Name: 3-iodo-1H-pyrrolo[2,3-b]pyridine-5-carboxylic acid methyl ester Formula: C9H7IN2O2 MolecularWeight: 302.06855

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C2C(=C1)C(=CN2)I

Isomeric SMILES

COC(=O)C1=CN=C2C(=C1)C(=CN2)I

InChI

InChI=1S/C9H7IN2O2/c1-14-9(13)5-2-6-7(10)4-12-8(6)11-3-5/h2-4H,1H3,(H,11,12)