2-[3-(4-bromophenyl)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl]oxyethanenitrile

Systemtic Name: 2-[3-(4-bromophenyl)-4-oxidanylidene-2-(trifluoromethyl)chromen-7-yl]oxyethanenitrile Openeye Name: 2-[3-(4-bromophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxyacetonitrile CAS Name: 2-[[3-(4-bromophenyl)-4-oxo-2-(trifluoromethyl)-1-benzopyran-7-yl]oxy]acetonitrile IUPAC Name: 2-[3-(4-bromophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl]oxyacetonitrile Traditional Name: 2-[3-(4-bromophenyl)-4-keto-2-(trifluoromethyl)chromen-7-yl]oxyacetonitrile Formula: C18H9BrF3NO3 MolecularWeight: 424.16817

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=C(OC3=C(C2=O)C=CC(=C3)OCC#N)C(F)(F)F)Br

Isomeric SMILES

C1=CC(=CC=C1C2=C(OC3=C(C2=O)C=CC(=C3)OCC#N)C(F)(F)F)Br

InChI

InChI=1S/C18H9BrF3NO3/c19-11-3-1-10(2-4-11)15-16(24)13-6-5-12(25-8-7-23)9-14(13)26-17(15)18(20,21)22/h1-6,9H,8H2