(E)-4-methyl-5-nitro-3-oxidanylidene-5-phenyl-pent-4-enoic acid

Systemtic Name: (E)-4-methyl-5-nitro-3-oxidanylidene-5-phenyl-pent-4-enoic acid Openeye Name: (E)-4-methyl-5-nitro-3-oxo-5-phenyl-pent-4-enoic acid CAS Name: (E)-4-methyl-5-nitro-3-oxo-5-phenyl-4-pentenoic acid IUPAC Name: (E)-4-methyl-5-nitro-3-oxo-5-phenylpent-4-enoic acid Traditional Name: (E)-3-keto-4-methyl-5-nitro-5-phenyl-pent-4-enoic acid Formula: C12H11NO5 MolecularWeight: 249.21944

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11NO5/c1-8(10(14)7-11(15)16)12(13(17)18)9-5-3-2-4-6-9/h2-6H,7H2,1H3,(H,15,16)/b12-8+