(4-oxidanylidene-3-phenyl-chromen-7-yl) 3,3-dimethylbutanoate

Systemtic Name: (4-oxidanylidene-3-phenyl-chromen-7-yl) 3,3-dimethylbutanoate Openeye Name: (4-oxo-3-phenyl-chromen-7-yl) 3,3-dimethylbutanoate CAS Name: 3,3-dimethylbutanoic acid (4-oxo-3-phenyl-1-benzopyran-7-yl) ester IUPAC Name: (4-oxo-3-phenylchromen-7-yl) 3,3-dimethylbutanoate Traditional Name: 3,3-dimethylbutyric acid (4-keto-3-phenyl-chromen-7-yl) ester Formula: C21H20O4 MolecularWeight: 336.3811

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)OC1=CC2=C(C=C1)C(=O)C(=CO2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)CC(=O)OC1=CC2=C(C=C1)C(=O)C(=CO2)C3=CC=CC=C3

InChI

InChI=1S/C21H20O4/c1-21(2,3)12-19(22)25-15-9-10-16-18(11-15)24-13-17(20(16)23)14-7-5-4-6-8-14/h4-11,13H,12H2,1-3H3