(2-oxidanylidene-1H-pyridin-3-yl) 3,5-dinitrobenzoate

Systemtic Name: (2-oxidanylidene-1H-pyridin-3-yl) 3,5-dinitrobenzoate Openeye Name: (2-oxo-1H-pyridin-3-yl) 3,5-dinitrobenzoate CAS Name: 3,5-dinitrobenzoic acid (2-oxo-1H-pyridin-3-yl) ester IUPAC Name: (2-oxo-1H-pyridin-3-yl) 3,5-dinitrobenzoate Traditional Name: 3,5-dinitrobenzoic acid (2-keto-1H-pyridin-3-yl) ester Formula: C12H7N3O7 MolecularWeight: 305.19988

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Descriptors Computed from Structure

Canonical SMILES:

C1=CNC(=O)C(=C1)OC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CNC(=O)C(=C1)OC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C12H7N3O7/c16-11-10(2-1-3-13-11)22-12(17)7-4-8(14(18)19)6-9(5-7)15(20)21/h1-6H,(H,13,16)