methyl N-[5-[2-chloranyl-3-(trifluoromethyl)phenoxy]-2-nitro-phenyl]carbonylcarbamate

Systemtic Name: methyl N-[5-[2-chloranyl-3-(trifluoromethyl)phenoxy]-2-nitro-phenyl]carbonylcarbamate Openeye Name: methyl N-[5-[2-chloro-3-(trifluoromethyl)phenoxy]-2-nitro-benzoyl]carbamate CAS Name: N-[[5-[2-chloro-3-(trifluoromethyl)phenoxy]-2-nitrophenyl]-oxomethyl]carbamic acid methyl ester IUPAC Name: methyl N-[5-[2-chloro-3-(trifluoromethyl)phenoxy]-2-nitrobenzoyl]carbamate Traditional Name: N-[5-[2-chloro-3-(trifluoromethyl)phenoxy]-2-nitro-benzoyl]carbamic acid methyl ester Formula: C16H10ClF3N2O6 MolecularWeight: 418.70861

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC(=O)C1=C(C=CC(=C1)OC2=CC=CC(=C2Cl)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

COC(=O)NC(=O)C1=C(C=CC(=C1)OC2=CC=CC(=C2Cl)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C16H10ClF3N2O6/c1-27-15(24)21-14(23)9-7-8(5-6-11(9)22(25)26)28-12-4-2-3-10(13(12)17)16(18,19)20/h2-7H,1H3,(H,21,23,24)