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

Systemtic Name: [2-oxidanylidene-2-(2,3,4,5-tetramethylphenyl)ethyl] 2-methyl-6-nitro-benzoate Openeye Name: [2-oxo-2-(2,3,4,5-tetramethylphenyl)ethyl] 2-methyl-6-nitro-benzoate CAS Name: 2-methyl-6-nitrobenzoic acid [2-oxo-2-(2,3,4,5-tetramethylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(2,3,4,5-tetramethylphenyl)ethyl] 2-methyl-6-nitrobenzoate Traditional Name: 2-methyl-6-nitro-benzoic acid [2-keto-2-(2,3,4,5-tetramethylphenyl)ethyl] ester Formula: C20H21NO5 MolecularWeight: 355.38444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)[N+](=O)[O-])C(=O)OCC(=O)C2=CC(=C(C(=C2C)C)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)[N+](=O)[O-])C(=O)OCC(=O)C2=CC(=C(C(=C2C)C)C)C

InChI

InChI=1S/C20H21NO5/c1-11-7-6-8-17(21(24)25)19(11)20(23)26-10-18(22)16-9-12(2)13(3)14(4)15(16)5/h6-9H,10H2,1-5H3