ethyl 4-acetyloxy-3-cyano-azulene-1-carboxylate

Systemtic Name: ethyl 4-acetyloxy-3-cyano-azulene-1-carboxylate Openeye Name: ethyl 4-acetoxy-3-cyano-azulene-1-carboxylate CAS Name: 4-acetyloxy-3-cyano-1-azulenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-acetyloxy-3-cyanoazulene-1-carboxylate Traditional Name: 4-acetoxy-3-cyano-azulene-1-carboxylic acid ethyl ester Formula: C16H13NO4 MolecularWeight: 283.27872

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C2C1=CC=CC=C2OC(=O)C)C#N

Isomeric SMILES

CCOC(=O)C1=CC(=C2C1=CC=CC=C2OC(=O)C)C#N

InChI

InChI=1S/C16H13NO4/c1-3-20-16(19)13-8-11(9-17)15-12(13)6-4-5-7-14(15)21-10(2)18/h4-8H,3H2,1-2H3