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

Systemtic Name: 3-chloranyl-5-ethoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]benzoate Openeye Name: 3-chloro-5-ethoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]benzoate CAS Name: 3-chloro-5-ethoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]benzoate IUPAC Name: 3-chloro-5-ethoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]benzoate Traditional Name: 3-chloro-5-ethoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]benzoate Formula: C16H10ClF3NO6- MolecularWeight: 404.70191

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C(=O)[O-])Cl)OC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C(=CC(=C1)C(=O)[O-])Cl)OC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C16H11ClF3NO6/c1-2-26-13-6-8(15(22)23)5-10(17)14(13)27-12-4-3-9(16(18,19)20)7-11(12)21(24)25/h3-7H,2H2,1H3,(H,22,23)/p-1