ethyl 6-(cyanomethyl)-4-oxidanylidene-1H-quinoline-3-carboxylate

Systemtic Name: ethyl 6-(cyanomethyl)-4-oxidanylidene-1H-quinoline-3-carboxylate Openeye Name: ethyl 6-(cyanomethyl)-4-oxo-1H-quinoline-3-carboxylate CAS Name: 6-(cyanomethyl)-4-oxo-1H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 6-(cyanomethyl)-4-oxo-1H-quinoline-3-carboxylate Traditional Name: 6-(cyanomethyl)-4-keto-1H-quinoline-3-carboxylic acid ethyl ester Formula: C14H12N2O3 MolecularWeight: 256.25668

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CNC2=C(C1=O)C=C(C=C2)CC#N

Isomeric SMILES

CCOC(=O)C1=CNC2=C(C1=O)C=C(C=C2)CC#N

InChI

InChI=1S/C14H12N2O3/c1-2-19-14(18)11-8-16-12-4-3-9(5-6-15)7-10(12)13(11)17/h3-4,7-8H,2,5H2,1H3,(H,16,17)