5-(2,2-dimethylpropanoyloxy)-2-(4-methoxyphenyl)-4-oxidanylidene-chromene-7-carboxylic acid

Systemtic Name: 5-(2,2-dimethylpropanoyloxy)-2-(4-methoxyphenyl)-4-oxidanylidene-chromene-7-carboxylic acid Openeye Name: 5-(2,2-dimethylpropanoyloxy)-2-(4-methoxyphenyl)-4-oxo-chromene-7-carboxylic acid CAS Name: 5-(2,2-dimethyl-1-oxopropoxy)-2-(4-methoxyphenyl)-4-oxo-1-benzopyran-7-carboxylic acid IUPAC Name: 5-(2,2-dimethylpropanoyloxy)-2-(4-methoxyphenyl)-4-oxochromene-7-carboxylic acid Traditional Name: 4-keto-2-(4-methoxyphenyl)-5-pivaloyloxy-chromene-7-carboxylic acid Formula: C22H20O7 MolecularWeight: 396.39

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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=C(C=C3)OC)C(=O)O

Isomeric SMILES

CC(C)(C)C(=O)OC1=CC(=CC2=C1C(=O)C=C(O2)C3=CC=C(C=C3)OC)C(=O)O

InChI

InChI=1S/C22H20O7/c1-22(2,3)21(26)29-18-10-13(20(24)25)9-17-19(18)15(23)11-16(28-17)12-5-7-14(27-4)8-6-12/h5-11H,1-4H3,(H,24,25)