methyl 4-chloranyl-3-nitro-5-oxidanyl-benzoate

Systemtic Name: methyl 4-chloranyl-3-nitro-5-oxidanyl-benzoate Openeye Name: methyl 4-chloro-3-hydroxy-5-nitro-benzoate CAS Name: 4-chloro-3-hydroxy-5-nitrobenzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-hydroxy-5-nitrobenzoate Traditional Name: 4-chloro-3-hydroxy-5-nitro-benzoic acid methyl ester Formula: C8H6ClNO5 MolecularWeight: 231.58994

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H6ClNO5/c1-15-8(12)4-2-5(10(13)14)7(9)6(11)3-4/h2-3,11H,1H3