methyl 4-(3-nitro-4-oxidanyl-phenyl)benzoate

Systemtic Name: methyl 4-(3-nitro-4-oxidanyl-phenyl)benzoate Openeye Name: methyl 4-(4-hydroxy-3-nitro-phenyl)benzoate CAS Name: 4-(4-hydroxy-3-nitrophenyl)benzoic acid methyl ester IUPAC Name: methyl 4-(4-hydroxy-3-nitrophenyl)benzoate Traditional Name: 4-(4-hydroxy-3-nitro-phenyl)benzoic acid methyl ester Formula: C14H11NO5 MolecularWeight: 273.24084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H11NO5/c1-20-14(17)10-4-2-9(3-5-10)11-6-7-13(16)12(8-11)15(18)19/h2-8,16H,1H3