3-oxidanylidenebut-1-en-2-yl 2,4-dinitrobenzoate

Systemtic Name: 3-oxidanylidenebut-1-en-2-yl 2,4-dinitrobenzoate Openeye Name: (1-methylene-2-oxo-propyl) 2,4-dinitrobenzoate CAS Name: 2,4-dinitrobenzoic acid 3-oxobut-1-en-2-yl ester IUPAC Name: 3-oxobut-1-en-2-yl 2,4-dinitrobenzoate Traditional Name: 2,4-dinitrobenzoic acid 1-acetylvinyl ester Formula: C11H8N2O7 MolecularWeight: 280.19042

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H8N2O7/c1-6(14)7(2)20-11(15)9-4-3-8(12(16)17)5-10(9)13(18)19/h3-5H,2H2,1H3