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

Systemtic Name: 4-[5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-phenoxy]-2-cyano-3-oxidanylidene-N-phenyl-N-propan-2-yl-pentanamide Openeye Name: 4-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-phenoxy]-2-cyano-N-isopropyl-3-oxo-N-phenyl-pentanamide CAS Name: 4-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrophenoxy]-2-cyano-3-oxo-N-phenyl-N-propan-2-ylpentanamide IUPAC Name: 4-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrophenoxy]-2-cyano-3-oxo-N-phenyl-N-propan-2-ylpentanamide Traditional Name: 4-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-phenoxy]-2-cyano-N-isopropyl-3-keto-N-phenyl-valeramide Formula: C28H23ClF3N3O6 MolecularWeight: 589.94693

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(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

CC(C)N(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/C28H23ClF3N3O6/c1-16(2)34(19-7-5-4-6-8-19)27(37)21(15-33)26(36)17(3)40-25-14-20(10-11-23(25)35(38)39)41-24-12-9-18(13-22(24)29)28(30,31)32/h4-14,16-17,21H,1-3H3