4-[5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-phenoxy]-3-oxidanylidene-2-pyrrolidin-1-ylcarbonyl-pentanenitrile

Systemtic Name: 4-[5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-nitro-phenoxy]-3-oxidanylidene-2-pyrrolidin-1-ylcarbonyl-pentanenitrile Openeye Name: 4-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-phenoxy]-3-oxo-2-(pyrrolidine-1-carbonyl)pentanenitrile CAS Name: 4-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrophenoxy]-3-oxo-2-[oxo(1-pyrrolidinyl)methyl]pentanenitrile IUPAC Name: 4-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrophenoxy]-3-oxo-2-(pyrrolidine-1-carbonyl)pentanenitrile Traditional Name: 4-[5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitro-phenoxy]-3-keto-2-(pyrrolidine-1-carbonyl)valeronitrile Formula: C23H19ClF3N3O6 MolecularWeight: 525.86167

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C(C#N)C(=O)N1CCCC1)OC2=C(C=CC(=C2)OC3=C(C=C(C=C3)C(F)(F)F)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)C(C#N)C(=O)N1CCCC1)OC2=C(C=CC(=C2)OC3=C(C=C(C=C3)C(F)(F)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C23H19ClF3N3O6/c1-13(21(31)16(12-28)22(32)29-8-2-3-9-29)35-20-11-15(5-6-18(20)30(33)34)36-19-7-4-14(10-17(19)24)23(25,26)27/h4-7,10-11,13,16H,2-3,8-9H2,1H3