O1-methyl O3-[2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl] 5-nitrobenzene-1,3-dicarboxylate

Systemtic Name: O1-methyl O3-[2-(1,2-oxazol-3-ylamino)-2-oxidanylidene-ethyl] 5-nitrobenzene-1,3-dicarboxylate Openeye Name: O3-[2-(isoxazol-3-ylamino)-2-oxo-ethyl] O1-methyl 5-nitrobenzene-1,3-dicarboxylate CAS Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(3-isoxazolylamino)-2-oxoethyl] ester O1-methyl ester IUPAC Name: 1-O-methyl 3-O-[2-(1,2-oxazol-3-ylamino)-2-oxoethyl] 5-nitrobenzene-1,3-dicarboxylate Traditional Name: 5-nitrobenzene-1,3-dicarboxylic acid O3-[2-(isoxazol-3-ylamino)-2-keto-ethyl] ester O1-methyl ester Formula: C14H11N3O8 MolecularWeight: 349.25244

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC(=O)NC2=NOC=C2

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)OCC(=O)NC2=NOC=C2

InChI

InChI=1S/C14H11N3O8/c1-23-13(19)8-4-9(6-10(5-8)17(21)22)14(20)24-7-12(18)15-11-2-3-25-16-11/h2-6H,7H2,1H3,(H,15,16,18)