5-(2,2-dimethylpropanoyloxy)-4-oxidanylidene-2-phenyl-chromene-7-carboxylate

Systemtic Name: 5-(2,2-dimethylpropanoyloxy)-4-oxidanylidene-2-phenyl-chromene-7-carboxylate Openeye Name: 5-(2,2-dimethylpropanoyloxy)-4-oxo-2-phenyl-chromene-7-carboxylate CAS Name: 5-(2,2-dimethyl-1-oxopropoxy)-4-oxo-2-phenyl-1-benzopyran-7-carboxylate IUPAC Name: 5-(2,2-dimethylpropanoyloxy)-4-oxo-2-phenylchromene-7-carboxylate Traditional Name: 4-keto-2-phenyl-5-pivaloyloxy-chromene-7-carboxylate Formula: C21H17O6- MolecularWeight: 365.35608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC1=CC(=CC2=C1C(=O)C=C(O2)C3=CC=CC=C3)C(=O)[O-]

Isomeric SMILES

CC(C)(C)C(=O)OC1=CC(=CC2=C1C(=O)C=C(O2)C3=CC=CC=C3)C(=O)[O-]

InChI

InChI=1S/C21H18O6/c1-21(2,3)20(25)27-17-10-13(19(23)24)9-16-18(17)14(22)11-15(26-16)12-7-5-4-6-8-12/h4-11H,1-3H3,(H,23,24)/p-1