4-[5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-phenoxy]-2-cyano-N-ethyl-3-oxidanylidene-N-phenyl-pentanamide

Systemtic Name: 4-[5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-phenoxy]-2-cyano-N-ethyl-3-oxidanylidene-N-phenyl-pentanamide Openeye Name: 4-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-phenoxy]-2-cyano-N-ethyl-3-oxo-N-phenyl-pentanamide CAS Name: 4-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrophenoxy]-2-cyano-N-ethyl-3-oxo-N-phenylpentanamide IUPAC Name: 4-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrophenoxy]-2-cyano-N-ethyl-3-oxo-N-phenylpentanamide Traditional Name: 4-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-phenoxy]-2-cyano-N-ethyl-3-keto-N-phenyl-valeramide Formula: C27H21ClF3N3O6 MolecularWeight: 575.92035

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C(=O)C(C#N)C(=O)C(C)OC2=C(C=CC(=C2)OC3=C(C=C(C=C3)C(F)(F)F)Cl)[N+](=O)[O-]

Isomeric SMILES

CCN(C1=CC=CC=C1)C(=O)C(C#N)C(=O)C(C)OC2=C(C=CC(=C2)OC3=C(C=C(C=C3)C(F)(F)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C27H21ClF3N3O6/c1-3-33(18-7-5-4-6-8-18)26(36)20(15-32)25(35)16(2)39-24-14-19(10-11-22(24)34(37)38)40-23-12-9-17(13-21(23)28)27(29,30)31/h4-14,16,20H,3H2,1-2H3