2-ethoxycarbonyl-4-(2-methoxy-6-nitro-phenyl)-3-oxidanylidene-butanoate

Systemtic Name: 2-ethoxycarbonyl-4-(2-methoxy-6-nitro-phenyl)-3-oxidanylidene-butanoate Openeye Name: 2-ethoxycarbonyl-4-(2-methoxy-6-nitro-phenyl)-3-oxo-butanoate CAS Name: 2-ethoxycarbonyl-4-(2-methoxy-6-nitrophenyl)-3-oxobutanoate IUPAC Name: 2-ethoxycarbonyl-4-(2-methoxy-6-nitrophenyl)-3-oxobutanoate Traditional Name: 2-carbethoxy-3-keto-4-(2-methoxy-6-nitro-phenyl)butyrate Formula: C14H14NO8- MolecularWeight: 324.26286

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(=O)CC1=C(C=CC=C1OC)[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

CCOC(=O)C(C(=O)CC1=C(C=CC=C1OC)[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C14H15NO8/c1-3-23-14(19)12(13(17)18)10(16)7-8-9(15(20)21)5-4-6-11(8)22-2/h4-6,12H,3,7H2,1-2H3,(H,17,18)/p-1