ethyl (2Z)-2-[(3-methoxy-5-nitro-4-oxidanyl-phenyl)methylidene]-3-oxidanylidene-butanoate

Systemtic Name: ethyl (2Z)-2-[(3-methoxy-5-nitro-4-oxidanyl-phenyl)methylidene]-3-oxidanylidene-butanoate Openeye Name: ethyl (2Z)-2-[(4-hydroxy-3-methoxy-5-nitro-phenyl)methylene]-3-oxo-butanoate CAS Name: (2Z)-2-[(4-hydroxy-3-methoxy-5-nitrophenyl)methylidene]-3-oxobutanoic acid ethyl ester IUPAC Name: ethyl (2Z)-2-[(4-hydroxy-3-methoxy-5-nitrophenyl)methylidene]-3-oxobutanoate Traditional Name: (Z)-2-acetyl-3-(4-hydroxy-3-methoxy-5-nitro-phenyl)acrylic acid ethyl ester Formula: C14H15NO7 MolecularWeight: 309.2714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15NO7/c1-4-22-14(18)10(8(2)16)5-9-6-11(15(19)20)13(17)12(7-9)21-3/h5-7,17H,4H2,1-3H3/b10-5-