ethyl 2-cyano-4-(2-nitrophenyl)-4-oxidanylidene-butanoate

Systemtic Name: ethyl 2-cyano-4-(2-nitrophenyl)-4-oxidanylidene-butanoate Openeye Name: ethyl 2-cyano-4-(2-nitrophenyl)-4-oxo-butanoate CAS Name: 2-cyano-4-(2-nitrophenyl)-4-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2-cyano-4-(2-nitrophenyl)-4-oxobutanoate Traditional Name: 2-cyano-4-keto-4-(2-nitrophenyl)butyric acid ethyl ester Formula: C13H12N2O5 MolecularWeight: 276.24478

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC(=O)C1=CC=CC=C1[N+](=O)[O-])C#N

Isomeric SMILES

CCOC(=O)C(CC(=O)C1=CC=CC=C1[N+](=O)[O-])C#N

InChI

InChI=1S/C13H12N2O5/c1-2-20-13(17)9(8-14)7-12(16)10-5-3-4-6-11(10)15(18)19/h3-6,9H,2,7H2,1H3