1-cyanoethenyl 2,4-dinitrobenzoate

Systemtic Name: 1-cyanoethenyl 2,4-dinitrobenzoate Openeye Name: 1-cyanovinyl 2,4-dinitrobenzoate CAS Name: 2,4-dinitrobenzoic acid 1-cyanoethenyl ester IUPAC Name: 1-cyanoethenyl 2,4-dinitrobenzoate Traditional Name: 2,4-dinitrobenzoic acid 1-cyanovinyl ester Formula: C10H5N3O6 MolecularWeight: 263.1632

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H5N3O6/c1-6(5-11)19-10(14)8-3-2-7(12(15)16)4-9(8)13(17)18/h2-4H,1H2