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

Systemtic Name: 3-[2-nitro-4-(trifluoromethyl)phenoxy]benzoate Openeye Name: 3-[2-nitro-4-(trifluoromethyl)phenoxy]benzoate CAS Name: 3-[2-nitro-4-(trifluoromethyl)phenoxy]benzoate IUPAC Name: 3-[2-nitro-4-(trifluoromethyl)phenoxy]benzoate Traditional Name: 3-[2-nitro-4-(trifluoromethyl)phenoxy]benzoate Formula: C14H7F3NO5- MolecularWeight: 326.20429

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H8F3NO5/c15-14(16,17)9-4-5-12(11(7-9)18(21)22)23-10-3-1-2-8(6-10)13(19)20/h1-7H,(H,19,20)/p-1