2-[1,3-dimethoxy-1,3-bis(oxidanylidene)propan-2-yl]-5-nitro-benzoic acid

Systemtic Name: 2-[1,3-dimethoxy-1,3-bis(oxidanylidene)propan-2-yl]-5-nitro-benzoic acid Openeye Name: 2-(2-methoxy-1-methoxycarbonyl-2-oxo-ethyl)-5-nitro-benzoic acid CAS Name: 2-(1,3-dimethoxy-1,3-dioxopropan-2-yl)-5-nitrobenzoic acid IUPAC Name: 2-(1,3-dimethoxy-1,3-dioxopropan-2-yl)-5-nitrobenzoic acid Traditional Name: 2-(1-carbomethoxy-2-keto-2-methoxy-ethyl)-5-nitro-benzoic acid Formula: C12H11NO8 MolecularWeight: 297.21764

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H11NO8/c1-20-11(16)9(12(17)21-2)7-4-3-6(13(18)19)5-8(7)10(14)15/h3-5,9H,1-2H3,(H,14,15)