5,7-bis[(2-methylpropan-2-yl)oxy-phenyl-methyl]-9-oxidanylidene-xanthene-2-carboxylic acid

Systemtic Name: 5,7-bis[(2-methylpropan-2-yl)oxy-phenyl-methyl]-9-oxidanylidene-xanthene-2-carboxylic acid Openeye Name: 5,7-bis[tert-butoxy(phenyl)methyl]-9-oxo-xanthene-2-carboxylic acid CAS Name: 5,7-bis[(2-methylpropan-2-yl)oxy-phenylmethyl]-9-oxo-2-xanthenecarboxylic acid IUPAC Name: 5,7-bis[(2-methylpropan-2-yl)oxy-phenylmethyl]-9-oxoxanthene-2-carboxylic acid Traditional Name: 5,7-bis[tert-butoxy(phenyl)methyl]-9-keto-xanthene-2-carboxylic acid Formula: C36H36O6 MolecularWeight: 564.66744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(C1=CC=CC=C1)C2=CC(=C3C(=C2)C(=O)C4=C(O3)C=CC(=C4)C(=O)O)C(C5=CC=CC=C5)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(C1=CC=CC=C1)C2=CC(=C3C(=C2)C(=O)C4=C(O3)C=CC(=C4)C(=O)O)C(C5=CC=CC=C5)OC(C)(C)C

InChI

InChI=1S/C36H36O6/c1-35(2,3)41-31(22-13-9-7-10-14-22)25-20-27-30(37)26-19-24(34(38)39)17-18-29(26)40-33(27)28(21-25)32(42-36(4,5)6)23-15-11-8-12-16-23/h7-21,31-32H,1-6H3,(H,38,39)