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

Systemtic Name: [2-oxidanylidene-2-(2,3,4,5-tetramethylphenyl)ethyl] 5-chloranyl-2-nitro-benzoate Openeye Name: [2-oxo-2-(2,3,4,5-tetramethylphenyl)ethyl] 5-chloro-2-nitro-benzoate CAS Name: 5-chloro-2-nitrobenzoic acid [2-oxo-2-(2,3,4,5-tetramethylphenyl)ethyl] ester IUPAC Name: [2-oxo-2-(2,3,4,5-tetramethylphenyl)ethyl] 5-chloro-2-nitrobenzoate Traditional Name: 5-chloro-2-nitro-benzoic acid [2-keto-2-(2,3,4,5-tetramethylphenyl)ethyl] ester Formula: C19H18ClNO5 MolecularWeight: 375.80292

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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)Cl)[N+](=O)[O-])C)C)C

Isomeric SMILES

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

InChI

InChI=1S/C19H18ClNO5/c1-10-7-15(13(4)12(3)11(10)2)18(22)9-26-19(23)16-8-14(20)5-6-17(16)21(24)25/h5-8H,9H2,1-4H3