[2-oxidanylidene-2-(2,3,5,6-tetramethylphenyl)ethyl] 4-nitro-3-oxidanyl-benzoate

Systemtic Name: [2-oxidanylidene-2-(2,3,5,6-tetramethylphenyl)ethyl] 4-nitro-3-oxidanyl-benzoate Openeye Name: [2-oxo-2-(2,3,5,6-tetramethylphenyl)ethyl] 3-hydroxy-4-nitro-benzoate CAS Name: 3-hydroxy-4-nitrobenzoic acid [2-oxo-2-(2,3,5,6-tetramethylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(2,3,5,6-tetramethylphenyl)ethyl] 3-hydroxy-4-nitrobenzoate Traditional Name: 3-hydroxy-4-nitro-benzoic acid [2-keto-2-(2,3,5,6-tetramethylphenyl)ethyl] ester Formula: C19H19NO6 MolecularWeight: 357.35726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)C(=O)COC(=O)C2=CC(=C(C=C2)[N+](=O)[O-])O)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1C)C(=O)COC(=O)C2=CC(=C(C=C2)[N+](=O)[O-])O)C)C

InChI

InChI=1S/C19H19NO6/c1-10-7-11(2)13(4)18(12(10)3)17(22)9-26-19(23)14-5-6-15(20(24)25)16(21)8-14/h5-8,21H,9H2,1-4H3