methyl 3-methyl-5-nitro-2-oxidanyl-benzoate

Systemtic Name: methyl 3-methyl-5-nitro-2-oxidanyl-benzoate Openeye Name: methyl 2-hydroxy-3-methyl-5-nitro-benzoate CAS Name: 2-hydroxy-3-methyl-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 2-hydroxy-3-methyl-5-nitrobenzoate Traditional Name: 2-hydroxy-3-methyl-5-nitro-benzoic acid methyl ester Formula: C9H9NO5 MolecularWeight: 211.17146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)[N+](=O)[O-])C(=O)OC)O

Isomeric SMILES

CC1=C(C(=CC(=C1)[N+](=O)[O-])C(=O)OC)O

InChI

InChI=1S/C9H9NO5/c1-5-3-6(10(13)14)4-7(8(5)11)9(12)15-2/h3-4,11H,1-2H3