ethyl 3-cyano-2-oxidanyl-azulene-1-carboxylate

Systemtic Name: ethyl 3-cyano-2-oxidanyl-azulene-1-carboxylate Openeye Name: ethyl 3-cyano-2-hydroxy-azulene-1-carboxylate CAS Name: 3-cyano-2-hydroxy-1-azulenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-cyano-2-hydroxyazulene-1-carboxylate Traditional Name: 3-cyano-2-hydroxy-azulene-1-carboxylic acid ethyl ester Formula: C14H11NO3 MolecularWeight: 241.24204

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C=CC=CC=C2C(=C1O)C#N

Isomeric SMILES

CCOC(=O)C1=C2C=CC=CC=C2C(=C1O)C#N

InChI

InChI=1S/C14H11NO3/c1-2-18-14(17)12-10-7-5-3-4-6-9(10)11(8-15)13(12)16/h3-7,16H,2H2,1H3