5-methyl-1-[(2-methylpropan-2-yl)oxy-phenyl-methyl]-9-oxidanylidene-xanthene-2-carboxylic acid

Systemtic Name: 5-methyl-1-[(2-methylpropan-2-yl)oxy-phenyl-methyl]-9-oxidanylidene-xanthene-2-carboxylic acid Openeye Name: 1-[tert-butoxy(phenyl)methyl]-5-methyl-9-oxo-xanthene-2-carboxylic acid CAS Name: 5-methyl-1-[(2-methylpropan-2-yl)oxy-phenylmethyl]-9-oxo-2-xanthenecarboxylic acid IUPAC Name: 5-methyl-1-[(2-methylpropan-2-yl)oxy-phenylmethyl]-9-oxoxanthene-2-carboxylic acid Traditional Name: 1-[tert-butoxy(phenyl)methyl]-9-keto-5-methyl-xanthene-2-carboxylic acid Formula: C26H24O5 MolecularWeight: 416.46576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1OC3=C(C2=O)C(=C(C=C3)C(=O)O)C(C4=CC=CC=C4)OC(C)(C)C

Isomeric SMILES

CC1=CC=CC2=C1OC3=C(C2=O)C(=C(C=C3)C(=O)O)C(C4=CC=CC=C4)OC(C)(C)C

InChI

InChI=1S/C26H24O5/c1-15-9-8-12-18-22(27)21-19(30-23(15)18)14-13-17(25(28)29)20(21)24(31-26(2,3)4)16-10-6-5-7-11-16/h5-14,24H,1-4H3,(H,28,29)