ethyl 2-cyano-2-(3-oxidanylidene-1,2-dihydrobenzo[de]isoquinolin-1-yl)ethanoate

Systemtic Name: ethyl 2-cyano-2-(3-oxidanylidene-1,2-dihydrobenzo[de]isoquinolin-1-yl)ethanoate Openeye Name: ethyl 2-cyano-2-(3-oxo-1,2-dihydrobenzo[de]isoquinolin-1-yl)acetate CAS Name: 2-cyano-2-(3-oxo-1,2-dihydrobenzo[de]isoquinolin-1-yl)acetic acid ethyl ester IUPAC Name: ethyl 2-cyano-2-(3-oxo-1,2-dihydrobenzo[de]isoquinolin-1-yl)acetate Traditional Name: 2-cyano-2-(3-keto-1,2-dihydrobenzo[de]isoquinolin-1-yl)acetic acid ethyl ester Formula: C17H14N2O3 MolecularWeight: 294.30466

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C#N)C1C2=CC=CC3=C2C(=CC=C3)C(=O)N1

Isomeric SMILES

CCOC(=O)C(C#N)C1C2=CC=CC3=C2C(=CC=C3)C(=O)N1

InChI

InChI=1S/C17H14N2O3/c1-2-22-17(21)13(9-18)15-11-7-3-5-10-6-4-8-12(14(10)11)16(20)19-15/h3-8,13,15H,2H2,1H3,(H,19,20)