2-[[5-bromanyl-2-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]methylidene]propanedinitrile

Systemtic Name: 2-[[5-bromanyl-2-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]methylidene]propanedinitrile Openeye Name: 2-[[5-bromo-2-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]methylene]propanedinitrile CAS Name: 2-[[5-bromo-2-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]methylidene]propanedinitrile IUPAC Name: 2-[[5-bromo-2-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]methylidene]propanedinitrile Traditional Name: 2-[5-bromo-2-[2-nitro-4-(trifluoromethyl)phenoxy]benzylidene]malononitrile Formula: C17H7BrF3N3O3 MolecularWeight: 438.15499

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])OC2=C(C=C(C=C2)Br)C=C(C#N)C#N

Isomeric SMILES

C1=CC(=C(C=C1C(F)(F)F)[N+](=O)[O-])OC2=C(C=C(C=C2)Br)C=C(C#N)C#N

InChI

InChI=1S/C17H7BrF3N3O3/c18-13-2-4-15(11(6-13)5-10(8-22)9-23)27-16-3-1-12(17(19,20)21)7-14(16)24(25)26/h1-7H