methyl 3-methoxy-7-nitro-1-oxidanylidene-isochromene-4-carboxylate

Systemtic Name: methyl 3-methoxy-7-nitro-1-oxidanylidene-isochromene-4-carboxylate Openeye Name: methyl 3-methoxy-7-nitro-1-oxo-isochromene-4-carboxylate CAS Name: 3-methoxy-7-nitro-1-oxo-2-benzopyran-4-carboxylic acid methyl ester IUPAC Name: methyl 3-methoxy-7-nitro-1-oxoisochromene-4-carboxylate Traditional Name: 1-keto-3-methoxy-7-nitro-isochromene-4-carboxylic acid methyl ester Formula: C12H9NO7 MolecularWeight: 279.20236

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O1)C(=O)OC

Isomeric SMILES

COC1=C(C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)O1)C(=O)OC

InChI

InChI=1S/C12H9NO7/c1-18-11(15)9-7-4-3-6(13(16)17)5-8(7)10(14)20-12(9)19-2/h3-5H,1-2H3