(2E)-2-[(2-nitro-4-oxidanyl-phenyl)methylidene]butanedioic acid

Systemtic Name: (2E)-2-[(2-nitro-4-oxidanyl-phenyl)methylidene]butanedioic acid Openeye Name: (2E)-2-[(4-hydroxy-2-nitro-phenyl)methylene]butanedioic acid CAS Name: (2E)-2-[(4-hydroxy-2-nitrophenyl)methylidene]butanedioic acid IUPAC Name: (2E)-2-[(4-hydroxy-2-nitrophenyl)methylidene]butanedioic acid Traditional Name: (2E)-2-(4-hydroxy-2-nitro-benzylidene)succinic acid Formula: C11H9NO7 MolecularWeight: 267.19166

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1O)[N+](=O)[O-])C=C(CC(=O)O)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1O)[N+](=O)[O-])/C=C(\CC(=O)O)/C(=O)O

InChI

InChI=1S/C11H9NO7/c13-8-2-1-6(9(5-8)12(18)19)3-7(11(16)17)4-10(14)15/h1-3,5,13H,4H2,(H,14,15)(H,16,17)/b7-3+