(E)-4-[(2-methyl-5-nitro-phenyl)amino]-4-oxidanylidene-but-2-enoate

Systemtic Name: (E)-4-[(2-methyl-5-nitro-phenyl)amino]-4-oxidanylidene-but-2-enoate Openeye Name: (E)-4-(2-methyl-5-nitro-anilino)-4-oxo-but-2-enoate CAS Name: (E)-4-(2-methyl-5-nitroanilino)-4-oxo-2-butenoate IUPAC Name: (E)-4-(2-methyl-5-nitroanilino)-4-oxobut-2-enoate Traditional Name: (E)-4-keto-4-(2-methyl-5-nitro-anilino)but-2-enoate Formula: C11H9N2O5- MolecularWeight: 249.19956

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H10N2O5/c1-7-2-3-8(13(17)18)6-9(7)12-10(14)4-5-11(15)16/h2-6H,1H3,(H,12,14)(H,15,16)/p-1/b5-4+