ethyl 3-(2-cyanopropan-2-yl)-1-oxidanylidene-4,5-dihydro-2H-2-benzazepine-3-carboxylate

Systemtic Name: ethyl 3-(2-cyanopropan-2-yl)-1-oxidanylidene-4,5-dihydro-2H-2-benzazepine-3-carboxylate Openeye Name: ethyl 3-(1-cyano-1-methyl-ethyl)-1-oxo-4,5-dihydro-2H-2-benzazepine-3-carboxylate CAS Name: 3-(2-cyanopropan-2-yl)-1-oxo-4,5-dihydro-2H-2-benzazepine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(2-cyanopropan-2-yl)-1-oxo-4,5-dihydro-2H-2-benzazepine-3-carboxylate Traditional Name: 3-(1-cyano-1-methyl-ethyl)-1-keto-4,5-dihydro-2H-2-benzazepine-3-carboxylic acid ethyl ester Formula: C17H20N2O3 MolecularWeight: 300.3523

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCC2=CC=CC=C2C(=O)N1)C(C)(C)C#N

Isomeric SMILES

CCOC(=O)C1(CCC2=CC=CC=C2C(=O)N1)C(C)(C)C#N

InChI

InChI=1S/C17H20N2O3/c1-4-22-15(21)17(16(2,3)11-18)10-9-12-7-5-6-8-13(12)14(20)19-17/h5-8H,4,9-10H2,1-3H3,(H,19,20)