(2E)-2-[(3-nitrophenyl)methylidene]-3-oxidanylidene-butanedioic acid

Systemtic Name: (2E)-2-[(3-nitrophenyl)methylidene]-3-oxidanylidene-butanedioic acid Openeye Name: (2E)-2-[(3-nitrophenyl)methylene]-3-oxo-butanedioic acid CAS Name: (2E)-2-[(3-nitrophenyl)methylidene]-3-oxobutanedioic acid IUPAC Name: (2E)-2-[(3-nitrophenyl)methylidene]-3-oxobutanedioic acid Traditional Name: (3E)-2-keto-3-(3-nitrobenzylidene)succinic acid Formula: C11H7NO7 MolecularWeight: 265.17578

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H7NO7/c13-9(11(16)17)8(10(14)15)5-6-2-1-3-7(4-6)12(18)19/h1-5H,(H,14,15)(H,16,17)/b8-5+