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

Systemtic Name: 2-propanoyloxyethyl 5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-benzoate Openeye Name: 2-propanoyloxyethyl 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-benzoate CAS Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrobenzoic acid 2-(1-oxopropoxy)ethyl ester IUPAC Name: 2-propanoyloxyethyl 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrobenzoate Traditional Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-benzoic acid 2-propionyloxyethyl ester Formula: C19H15ClF3NO7 MolecularWeight: 461.77311

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H15ClF3NO7/c1-2-17(25)29-7-8-30-18(26)13-10-12(4-5-15(13)24(27)28)31-16-6-3-11(9-14(16)20)19(21,22)23/h3-6,9-10H,2,7-8H2,1H3