[2-oxidanylidene-2-(2,3,5,6-tetramethylphenyl)ethyl] 3-nitrobenzoate

Systemtic Name: [2-oxidanylidene-2-(2,3,5,6-tetramethylphenyl)ethyl] 3-nitrobenzoate Openeye Name: [2-oxo-2-(2,3,5,6-tetramethylphenyl)ethyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [2-oxo-2-(2,3,5,6-tetramethylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(2,3,5,6-tetramethylphenyl)ethyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [2-keto-2-(2,3,5,6-tetramethylphenyl)ethyl] ester Formula: C19H19NO5 MolecularWeight: 341.35786

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H19NO5/c1-11-8-12(2)14(4)18(13(11)3)17(21)10-25-19(22)15-6-5-7-16(9-15)20(23)24/h5-9H,10H2,1-4H3