ethyl (2Z)-2-[(3-nitro-4-oxidanyl-phenyl)methylidene]-3-oxidanylidene-butanoate

Systemtic Name: ethyl (2Z)-2-[(3-nitro-4-oxidanyl-phenyl)methylidene]-3-oxidanylidene-butanoate Openeye Name: ethyl (2Z)-2-[(4-hydroxy-3-nitro-phenyl)methylene]-3-oxo-butanoate CAS Name: (2Z)-2-[(4-hydroxy-3-nitrophenyl)methylidene]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl (2Z)-2-[(4-hydroxy-3-nitrophenyl)methylidene]-3-oxobutanoate Traditional Name: (Z)-2-acetyl-3-(4-hydroxy-3-nitro-phenyl)acrylic acid ethyl ester Formula: C13H13NO6 MolecularWeight: 279.24542

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CC1=CC(=C(C=C1)O)[N+](=O)[O-])C(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C13H13NO6/c1-3-20-13(17)10(8(2)15)6-9-4-5-12(16)11(7-9)14(18)19/h4-7,16H,3H2,1-2H3/b10-6-