[2-oxidanylidene-2-(2,3,4,5,6-pentamethylphenyl)ethyl] 2-nitrobenzoate

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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