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

Systemtic Name: ethyl (5E)-2-methyl-5-[(2-nitrophenyl)methylidene]-4-oxidanylidene-1H-pyrrole-3-carboxylate Openeye Name: ethyl (5E)-2-methyl-5-[(2-nitrophenyl)methylene]-4-oxo-1H-pyrrole-3-carboxylate CAS Name: (5E)-2-methyl-5-[(2-nitrophenyl)methylidene]-4-oxo-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl (5E)-2-methyl-5-[(2-nitrophenyl)methylidene]-4-oxo-1H-pyrrole-3-carboxylate Traditional Name: (5E)-4-keto-2-methyl-5-(2-nitrobenzylidene)-2-pyrroline-3-carboxylic acid ethyl ester Formula: C15H14N2O5 MolecularWeight: 302.28206

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=CC2=CC=CC=C2[N+](=O)[O-])C1=O)C

Isomeric SMILES

CCOC(=O)C1=C(N/C(=C/C2=CC=CC=C2[N+](=O)[O-])/C1=O)C

InChI

InChI=1S/C15H14N2O5/c1-3-22-15(19)13-9(2)16-11(14(13)18)8-10-6-4-5-7-12(10)17(20)21/h4-8,16H,3H2,1-2H3/b11-8+