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

Systemtic Name: [2-oxidanylidene-2-(2,3,4,5-tetramethylphenyl)ethyl] 2-methoxy-5-nitro-benzoate Openeye Name: [2-oxo-2-(2,3,4,5-tetramethylphenyl)ethyl] 2-methoxy-5-nitro-benzoate CAS Name: 2-methoxy-5-nitrobenzoic acid [2-oxo-2-(2,3,4,5-tetramethylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(2,3,4,5-tetramethylphenyl)ethyl] 2-methoxy-5-nitrobenzoate Traditional Name: 2-methoxy-5-nitro-benzoic acid [2-keto-2-(2,3,4,5-tetramethylphenyl)ethyl] ester Formula: C20H21NO6 MolecularWeight: 371.38384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1)C(=O)COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])OC)C)C)C

Isomeric SMILES

CC1=C(C(=C(C(=C1)C(=O)COC(=O)C2=C(C=CC(=C2)[N+](=O)[O-])OC)C)C)C

InChI

InChI=1S/C20H21NO6/c1-11-8-16(14(4)13(3)12(11)2)18(22)10-27-20(23)17-9-15(21(24)25)6-7-19(17)26-5/h6-9H,10H2,1-5H3