ethyl 2-ethyl-1,3,4-tris(oxidanylidene)isoquinoline-5-carboxylate

Systemtic Name: ethyl 2-ethyl-1,3,4-tris(oxidanylidene)isoquinoline-5-carboxylate Openeye Name: ethyl 2-ethyl-1,3,4-trioxo-isoquinoline-5-carboxylate CAS Name: 2-ethyl-1,3,4-trioxo-5-isoquinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-ethyl-1,3,4-trioxoisoquinoline-5-carboxylate Traditional Name: 2-ethyl-1,3,4-triketo-isoquinoline-5-carboxylic acid ethyl ester Formula: C14H13NO5 MolecularWeight: 275.25672

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C(=CC=C2)C(=O)OCC)C(=O)C1=O

Isomeric SMILES

CCN1C(=O)C2=C(C(=CC=C2)C(=O)OCC)C(=O)C1=O

InChI

InChI=1S/C14H13NO5/c1-3-15-12(17)8-6-5-7-9(14(19)20-4-2)10(8)11(16)13(15)18/h5-7H,3-4H2,1-2H3