ethyl 9-cyano-6-oxidanyl-2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepine-7-carboxylate

Systemtic Name: ethyl 9-cyano-6-oxidanyl-2-oxidanylidene-1,3,4,5-tetrahydro-1-benzazepine-7-carboxylate Openeye Name: ethyl 9-cyano-6-hydroxy-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-7-carboxylate CAS Name: 9-cyano-6-hydroxy-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-7-carboxylic acid ethyl ester IUPAC Name: ethyl 9-cyano-6-hydroxy-2-oxo-1,3,4,5-tetrahydro-1-benzazepine-7-carboxylate Traditional Name: 9-cyano-6-hydroxy-2-keto-1,3,4,5-tetrahydro-1-benzazepine-7-carboxylic acid ethyl ester Formula: C14H14N2O4 MolecularWeight: 274.27196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C(=C1)C#N)NC(=O)CCC2)O

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C(=C1)C#N)NC(=O)CCC2)O

InChI

InChI=1S/C14H14N2O4/c1-2-20-14(19)10-6-8(7-15)12-9(13(10)18)4-3-5-11(17)16-12/h6,18H,2-5H2,1H3,(H,16,17)