2-methylprop-2-enyl 5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-benzoate

Systemtic Name: 2-methylprop-2-enyl 5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-benzoate Openeye Name: 2-methylallyl 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-benzoate CAS Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrobenzoic acid 2-methylprop-2-enyl ester IUPAC Name: 2-methylprop-2-enyl 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrobenzoate Traditional Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-benzoic acid 2-methylallyl ester Formula: C18H13ClF3NO5 MolecularWeight: 415.74773

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)COC(=O)C1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(=C)COC(=O)C1=C(C=CC(=C1)OC2=C(C=C(C=C2)C(F)(F)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H13ClF3NO5/c1-10(2)9-27-17(24)13-8-12(4-5-15(13)23(25)26)28-16-6-3-11(7-14(16)19)18(20,21)22/h3-8H,1,9H2,2H3