(1-acetyloxy-2-chloranyl-ethyl) 5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-benzoate

Systemtic Name: (1-acetyloxy-2-chloranyl-ethyl) 5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-benzoate Openeye Name: (1-acetoxy-2-chloro-ethyl) 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-benzoate CAS Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrobenzoic acid (1-acetyloxy-2-chloroethyl) ester IUPAC Name: (1-acetyloxy-2-chloroethyl) 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrobenzoate Traditional Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-benzoic acid (1-acetoxy-2-chloro-ethyl) ester Formula: C18H12Cl2F3NO7 MolecularWeight: 482.19159

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H12Cl2F3NO7/c1-9(25)29-16(8-19)31-17(26)12-7-11(3-4-14(12)24(27)28)30-15-5-2-10(6-13(15)20)18(21,22)23/h2-7,16H,8H2,1H3