[2-(4-methyl-3-nitro-phenyl)-2-oxidanylidene-ethyl] 2-chloranyl-4,5-bis(fluoranyl)benzoate

Systemtic Name: [2-(4-methyl-3-nitro-phenyl)-2-oxidanylidene-ethyl] 2-chloranyl-4,5-bis(fluoranyl)benzoate Openeye Name: [2-(4-methyl-3-nitro-phenyl)-2-oxo-ethyl] 2-chloro-4,5-difluoro-benzoate CAS Name: 2-chloro-4,5-difluorobenzoic acid [2-(4-methyl-3-nitrophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-methyl-3-nitrophenyl)-2-oxoethyl] 2-chloro-4,5-difluorobenzoate Traditional Name: 2-chloro-4,5-difluoro-benzoic acid [2-keto-2-(4-methyl-3-nitro-phenyl)ethyl] ester Formula: C16H10ClF2NO5 MolecularWeight: 369.704106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)COC(=O)C2=CC(=C(C=C2Cl)F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)COC(=O)C2=CC(=C(C=C2Cl)F)F)[N+](=O)[O-]

InChI

InChI=1S/C16H10ClF2NO5/c1-8-2-3-9(4-14(8)20(23)24)15(21)7-25-16(22)10-5-12(18)13(19)6-11(10)17/h2-6H,7H2,1H3