5-[[2-(4-tert-butylphenyl)-6,7-dimethyl-4-oxidanylidene-chromen-3-yl]oxymethyl]furan-2-carboxylic acid

Systemtic Name: 5-[[2-(4-tert-butylphenyl)-6,7-dimethyl-4-oxidanylidene-chromen-3-yl]oxymethyl]furan-2-carboxylic acid Openeye Name: 5-[[2-(4-tert-butylphenyl)-6,7-dimethyl-4-oxo-chromen-3-yl]oxymethyl]furan-2-carboxylic acid CAS Name: 5-[[2-(4-tert-butylphenyl)-6,7-dimethyl-4-oxo-1-benzopyran-3-yl]oxymethyl]-2-furancarboxylic acid IUPAC Name: 5-[[2-(4-tert-butylphenyl)-6,7-dimethyl-4-oxochromen-3-yl]oxymethyl]furan-2-carboxylic acid Traditional Name: 5-[[2-(4-tert-butylphenyl)-4-keto-6,7-dimethyl-chromen-3-yl]oxymethyl]-2-furoic acid Formula: C27H26O6 MolecularWeight: 446.49174

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC=C(C=C3)C(C)(C)C)OCC4=CC=C(O4)C(=O)O)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=O)C(=C(O2)C3=CC=C(C=C3)C(C)(C)C)OCC4=CC=C(O4)C(=O)O)C

InChI

InChI=1S/C27H26O6/c1-15-12-20-22(13-16(15)2)33-24(17-6-8-18(9-7-17)27(3,4)5)25(23(20)28)31-14-19-10-11-21(32-19)26(29)30/h6-13H,14H2,1-5H3,(H,29,30)