ethyl 2-[4,5-bis(chloranyl)-2-nitro-phenyl]-3-oxidanylidene-butanoate

Systemtic Name: ethyl 2-[4,5-bis(chloranyl)-2-nitro-phenyl]-3-oxidanylidene-butanoate Openeye Name: ethyl 2-(4,5-dichloro-2-nitro-phenyl)-3-oxo-butanoate CAS Name: 2-(4,5-dichloro-2-nitrophenyl)-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl 2-(4,5-dichloro-2-nitrophenyl)-3-oxobutanoate Traditional Name: 2-(4,5-dichloro-2-nitro-phenyl)-3-keto-butyric acid ethyl ester Formula: C12H11Cl2NO5 MolecularWeight: 320.12544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11Cl2NO5/c1-3-20-12(17)11(6(2)16)7-4-8(13)9(14)5-10(7)15(18)19/h4-5,11H,3H2,1-2H3