2-[2-(4-tert-butylphenyl)-4-oxidanylidene-chromen-3-yl]oxyethanenitrile

Systemtic Name: 2-[2-(4-tert-butylphenyl)-4-oxidanylidene-chromen-3-yl]oxyethanenitrile Openeye Name: 2-[2-(4-tert-butylphenyl)-4-oxo-chromen-3-yl]oxyacetonitrile CAS Name: 2-[[2-(4-tert-butylphenyl)-4-oxo-1-benzopyran-3-yl]oxy]acetonitrile IUPAC Name: 2-[2-(4-tert-butylphenyl)-4-oxochromen-3-yl]oxyacetonitrile Traditional Name: 2-[2-(4-tert-butylphenyl)-4-keto-chromen-3-yl]oxyacetonitrile Formula: C21H19NO3 MolecularWeight: 333.38046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=C(C(=O)C3=CC=CC=C3O2)OCC#N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=C(C(=O)C3=CC=CC=C3O2)OCC#N

InChI

InChI=1S/C21H19NO3/c1-21(2,3)15-10-8-14(9-11-15)19-20(24-13-12-22)18(23)16-6-4-5-7-17(16)25-19/h4-11H,13H2,1-3H3