ethyl 5-cyano-6-oxidanylidene-11H-benzo[b][1]benzazepine-5-carboxylate

Systemtic Name: ethyl 5-cyano-6-oxidanylidene-11H-benzo[b][1]benzazepine-5-carboxylate Openeye Name: ethyl 5-cyano-6-oxo-11H-benzo[b][1]benzazepine-5-carboxylate CAS Name: 5-cyano-6-oxo-11H-benzo[b][1]benzazepine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 5-cyano-6-oxo-11H-benzo[b][1]benzazepine-5-carboxylate Traditional Name: 5-cyano-6-keto-11H-benzo[b][1]benzazepine-5-carboxylic acid ethyl ester Formula: C18H14N2O3 MolecularWeight: 306.31536

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C2=CC=CC=C2NC3=CC=CC=C3C1=O)C#N

Isomeric SMILES

CCOC(=O)C1(C2=CC=CC=C2NC3=CC=CC=C3C1=O)C#N

InChI

InChI=1S/C18H14N2O3/c1-2-23-17(22)18(11-19)13-8-4-6-10-15(13)20-14-9-5-3-7-12(14)16(18)21/h3-10,20H,2H2,1H3