[2,3,6-tris(fluoranyl)-4-methyl-phenyl]methyl 2-chloranyl-6-nitro-3-oxidanyl-benzoate

Systemtic Name: [2,3,6-tris(fluoranyl)-4-methyl-phenyl]methyl 2-chloranyl-6-nitro-3-oxidanyl-benzoate Openeye Name: (2,3,6-trifluoro-4-methyl-phenyl)methyl 2-chloro-3-hydroxy-6-nitro-benzoate CAS Name: 2-chloro-3-hydroxy-6-nitrobenzoic acid (2,3,6-trifluoro-4-methylphenyl)methyl ester IUPAC Name: (2,3,6-trifluoro-4-methylphenyl)methyl 2-chloro-3-hydroxy-6-nitrobenzoate Traditional Name: 2-chloro-3-hydroxy-6-nitro-benzoic acid (2,3,6-trifluoro-4-methyl-benzyl) ester Formula: C15H9ClF3NO5 MolecularWeight: 375.68387

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1F)F)COC(=O)C2=C(C=CC(=C2Cl)O)[N+](=O)[O-])F

Isomeric SMILES

CC1=CC(=C(C(=C1F)F)COC(=O)C2=C(C=CC(=C2Cl)O)[N+](=O)[O-])F

InChI

InChI=1S/C15H9ClF3NO5/c1-6-4-8(17)7(14(19)13(6)18)5-25-15(22)11-9(20(23)24)2-3-10(21)12(11)16/h2-4,21H,5H2,1H3