(5E)-2-methyl-5-[(2-nitrophenyl)methylidene]-4-oxidanylidene-1H-pyrrole-3-carboxylic acid

Systemtic Name: (5E)-2-methyl-5-[(2-nitrophenyl)methylidene]-4-oxidanylidene-1H-pyrrole-3-carboxylic acid Openeye Name: (5E)-2-methyl-5-[(2-nitrophenyl)methylene]-4-oxo-1H-pyrrole-3-carboxylic acid CAS Name: (5E)-2-methyl-5-[(2-nitrophenyl)methylidene]-4-oxo-1H-pyrrole-3-carboxylic acid IUPAC Name: (5E)-2-methyl-5-[(2-nitrophenyl)methylidene]-4-oxo-1H-pyrrole-3-carboxylic acid Traditional Name: (5E)-4-keto-2-methyl-5-(2-nitrobenzylidene)-2-pyrroline-3-carboxylic acid Formula: C13H10N2O5 MolecularWeight: 274.2289

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C(=CC2=CC=CC=C2[N+](=O)[O-])N1)C(=O)O

Isomeric SMILES

CC1=C(C(=O)/C(=C\C2=CC=CC=C2[N+](=O)[O-])/N1)C(=O)O

InChI

InChI=1S/C13H10N2O5/c1-7-11(13(17)18)12(16)9(14-7)6-8-4-2-3-5-10(8)15(19)20/h2-6,14H,1H3,(H,17,18)/b9-6+