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

Systemtic Name: 5-[[3-(3,5-dimethylphenoxy)-4-oxidanylidene-chromen-7-yl]oxymethyl]furan-2-carboxylic acid Openeye Name: 5-[[3-(3,5-dimethylphenoxy)-4-oxo-chromen-7-yl]oxymethyl]furan-2-carboxylic acid CAS Name: 5-[[3-(3,5-dimethylphenoxy)-4-oxo-1-benzopyran-7-yl]oxymethyl]-2-furancarboxylic acid IUPAC Name: 5-[[3-(3,5-dimethylphenoxy)-4-oxochromen-7-yl]oxymethyl]furan-2-carboxylic acid Traditional Name: 5-[[3-(3,5-dimethylphenoxy)-4-keto-chromen-7-yl]oxymethyl]-2-furoic acid Formula: C23H18O7 MolecularWeight: 406.38482

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=COC3=C(C2=O)C=CC(=C3)OCC4=CC=C(O4)C(=O)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=COC3=C(C2=O)C=CC(=C3)OCC4=CC=C(O4)C(=O)O)C

InChI

InChI=1S/C23H18O7/c1-13-7-14(2)9-17(8-13)30-21-12-28-20-10-15(3-5-18(20)22(21)24)27-11-16-4-6-19(29-16)23(25)26/h3-10,12H,11H2,1-2H3,(H,25,26)