5-[[3-(2-tert-butylphenoxy)-4-oxidanylidene-chromen-7-yl]oxymethyl]furan-2-carboxylic acid

Systemtic Name: 5-[[3-(2-tert-butylphenoxy)-4-oxidanylidene-chromen-7-yl]oxymethyl]furan-2-carboxylic acid Openeye Name: 5-[[3-(2-tert-butylphenoxy)-4-oxo-chromen-7-yl]oxymethyl]furan-2-carboxylic acid CAS Name: 5-[[3-(2-tert-butylphenoxy)-4-oxo-1-benzopyran-7-yl]oxymethyl]-2-furancarboxylic acid IUPAC Name: 5-[[3-(2-tert-butylphenoxy)-4-oxochromen-7-yl]oxymethyl]furan-2-carboxylic acid Traditional Name: 5-[[3-(2-tert-butylphenoxy)-4-keto-chromen-7-yl]oxymethyl]-2-furoic acid Formula: C25H22O7 MolecularWeight: 434.43798

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1OC2=COC3=C(C2=O)C=CC(=C3)OCC4=CC=C(O4)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1OC2=COC3=C(C2=O)C=CC(=C3)OCC4=CC=C(O4)C(=O)O

InChI

InChI=1S/C25H22O7/c1-25(2,3)18-6-4-5-7-19(18)32-22-14-30-21-12-15(8-10-17(21)23(22)26)29-13-16-9-11-20(31-16)24(27)28/h4-12,14H,13H2,1-3H3,(H,27,28)