ethyl 3-bromanyl-4-cyano-4H-pyridine-1-carboxylate

Systemtic Name: ethyl 3-bromanyl-4-cyano-4H-pyridine-1-carboxylate Openeye Name: ethyl 3-bromo-4-cyano-4H-pyridine-1-carboxylate CAS Name: 3-bromo-4-cyano-4H-pyridine-1-carboxylic acid ethyl ester IUPAC Name: ethyl 3-bromo-4-cyano-4H-pyridine-1-carboxylate Traditional Name: 3-bromo-4-cyano-4H-pyridine-1-carboxylic acid ethyl ester Formula: C9H9BrN2O2 MolecularWeight: 257.08396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C=CC(C(=C1)Br)C#N

Isomeric SMILES

CCOC(=O)N1C=CC(C(=C1)Br)C#N

InChI

InChI=1S/C9H9BrN2O2/c1-2-14-9(13)12-4-3-7(5-11)8(10)6-12/h3-4,6-7H,2H2,1H3