methyl 6-cyano-3-nitro-2-oxidanyl-benzoate

Systemtic Name: methyl 6-cyano-3-nitro-2-oxidanyl-benzoate Openeye Name: methyl 6-cyano-2-hydroxy-3-nitro-benzoate CAS Name: 6-cyano-2-hydroxy-3-nitrobenzoic acid methyl ester IUPAC Name: methyl 6-cyano-2-hydroxy-3-nitrobenzoate Traditional Name: 6-cyano-2-hydroxy-3-nitro-benzoic acid methyl ester Formula: C9H6N2O5 MolecularWeight: 222.15434

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1O)[N+](=O)[O-])C#N

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1O)[N+](=O)[O-])C#N

InChI

InChI=1S/C9H6N2O5/c1-16-9(13)7-5(4-10)2-3-6(8(7)12)11(14)15/h2-3,12H,1H3