4-[4-[2-chloranyl-4-(trifluoromethyl)phenoxy]phenoxy]-3-oxidanylidene-2-quinoxalin-2-yl-pentanenitrile

Systemtic Name: 4-[4-[2-chloranyl-4-(trifluoromethyl)phenoxy]phenoxy]-3-oxidanylidene-2-quinoxalin-2-yl-pentanenitrile Openeye Name: 4-[4-[2-chloro-4-(trifluoromethyl)phenoxy]phenoxy]-3-oxo-2-quinoxalin-2-yl-pentanenitrile CAS Name: 4-[4-[2-chloro-4-(trifluoromethyl)phenoxy]phenoxy]-3-oxo-2-(2-quinoxalinyl)pentanenitrile IUPAC Name: 4-[4-[2-chloro-4-(trifluoromethyl)phenoxy]phenoxy]-3-oxo-2-quinoxalin-2-ylpentanenitrile Traditional Name: 4-[4-[2-chloro-4-(trifluoromethyl)phenoxy]phenoxy]-3-keto-2-quinoxalin-2-yl-valeronitrile Formula: C26H17ClF3N3O3 MolecularWeight: 511.87969

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C(C#N)C1=NC2=CC=CC=C2N=C1)OC3=CC=C(C=C3)OC4=C(C=C(C=C4)C(F)(F)F)Cl

Isomeric SMILES

CC(C(=O)C(C#N)C1=NC2=CC=CC=C2N=C1)OC3=CC=C(C=C3)OC4=C(C=C(C=C4)C(F)(F)F)Cl

InChI

InChI=1S/C26H17ClF3N3O3/c1-15(25(34)19(13-31)23-14-32-21-4-2-3-5-22(21)33-23)35-17-7-9-18(10-8-17)36-24-11-6-16(12-20(24)27)26(28,29)30/h2-12,14-15,19H,1H3