(E,4E)-3-methyl-4-[(3-nitrophenyl)methylidene]pent-2-enedioic acid

Systemtic Name: (E,4E)-3-methyl-4-[(3-nitrophenyl)methylidene]pent-2-enedioic acid Openeye Name: (E,4E)-3-methyl-4-[(3-nitrophenyl)methylene]pent-2-enedioic acid CAS Name: (E,4E)-3-methyl-4-[(3-nitrophenyl)methylidene]-2-pentenedioic acid IUPAC Name: (E,4E)-3-methyl-4-[(3-nitrophenyl)methylidene]pent-2-enedioic acid Traditional Name: (E,4E)-3-methyl-4-(3-nitrobenzylidene)pent-2-enedioic acid Formula: C13H11NO6 MolecularWeight: 277.22954

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11NO6/c1-8(5-12(15)16)11(13(17)18)7-9-3-2-4-10(6-9)14(19)20/h2-7H,1H3,(H,15,16)(H,17,18)/b8-5+,11-7+