methyl 4-(5-chloranyl-2-methoxy-3-nitro-phenyl)-4-oxidanylidene-butanoate

Systemtic Name: methyl 4-(5-chloranyl-2-methoxy-3-nitro-phenyl)-4-oxidanylidene-butanoate Openeye Name: methyl 4-(5-chloro-2-methoxy-3-nitro-phenyl)-4-oxo-butanoate CAS Name: 4-(5-chloro-2-methoxy-3-nitrophenyl)-4-oxobutanoic acid methyl ester IUPAC Name: methyl 4-(5-chloro-2-methoxy-3-nitrophenyl)-4-oxobutanoate Traditional Name: 4-(5-chloro-2-methoxy-3-nitro-phenyl)-4-keto-butyric acid methyl ester Formula: C12H12ClNO6 MolecularWeight: 301.67978

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1C(=O)CCC(=O)OC)Cl)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1C(=O)CCC(=O)OC)Cl)[N+](=O)[O-]

InChI

InChI=1S/C12H12ClNO6/c1-19-11(16)4-3-10(15)8-5-7(13)6-9(14(17)18)12(8)20-2/h5-6H,3-4H2,1-2H3