5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-morpholin-4-ylcarbonyl-2-(2-nitrophenoxy)-3-oxidanylidene-pentanenitrile

Systemtic Name: 5-[2-chloranyl-4-(trifluoromethyl)phenoxy]-2-morpholin-4-ylcarbonyl-2-(2-nitrophenoxy)-3-oxidanylidene-pentanenitrile Openeye Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-(morpholine-4-carbonyl)-2-(2-nitrophenoxy)-3-oxo-pentanenitrile CAS Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-[4-morpholinyl(oxo)methyl]-2-(2-nitrophenoxy)-3-oxopentanenitrile IUPAC Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-(morpholine-4-carbonyl)-2-(2-nitrophenoxy)-3-oxopentanenitrile Traditional Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-3-keto-2-(morpholine-4-carbonyl)-2-(2-nitrophenoxy)valeronitrile Formula: C23H19ClF3N3O7 MolecularWeight: 541.86107

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)C(C#N)(C(=O)CCOC2=C(C=C(C=C2)C(F)(F)F)Cl)OC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C(=O)C(C#N)(C(=O)CCOC2=C(C=C(C=C2)C(F)(F)F)Cl)OC3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C23H19ClF3N3O7/c24-16-13-15(23(25,26)27)5-6-18(16)36-10-7-20(31)22(14-28,21(32)29-8-11-35-12-9-29)37-19-4-2-1-3-17(19)30(33)34/h1-6,13H,7-12H2