(2E)-4-acetyloxy-2-[(3-nitrophenyl)methylidene]-3-oxidanylidene-butanoic acid

Systemtic Name: (2E)-4-acetyloxy-2-[(3-nitrophenyl)methylidene]-3-oxidanylidene-butanoic acid Openeye Name: (2E)-4-acetoxy-2-[(3-nitrophenyl)methylene]-3-oxo-butanoic acid CAS Name: (2E)-4-acetyloxy-2-[(3-nitrophenyl)methylidene]-3-oxobutanoic acid IUPAC Name: (2E)-4-acetyloxy-2-[(3-nitrophenyl)methylidene]-3-oxobutanoic acid Traditional Name: (E)-2-(2-acetoxyacetyl)-3-(3-nitrophenyl)acrylic acid Formula: C13H11NO7 MolecularWeight: 293.22894

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11NO7/c1-8(15)21-7-12(16)11(13(17)18)6-9-3-2-4-10(5-9)14(19)20/h2-6H,7H2,1H3,(H,17,18)/b11-6+