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

Systemtic Name: 5-methyl-7-[(2-methylpropan-2-yl)oxy-phenyl-methyl]-9-oxidanylidene-xanthene-2-carboxylic acid Openeye Name: 7-[tert-butoxy(phenyl)methyl]-5-methyl-9-oxo-xanthene-2-carboxylic acid CAS Name: 5-methyl-7-[(2-methylpropan-2-yl)oxy-phenylmethyl]-9-oxo-2-xanthenecarboxylic acid IUPAC Name: 5-methyl-7-[(2-methylpropan-2-yl)oxy-phenylmethyl]-9-oxoxanthene-2-carboxylic acid Traditional Name: 7-[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=C2C(=CC(=C1)C(C3=CC=CC=C3)OC(C)(C)C)C(=O)C4=C(O2)C=CC(=C4)C(=O)O

Isomeric SMILES

CC1=C2C(=CC(=C1)C(C3=CC=CC=C3)OC(C)(C)C)C(=O)C4=C(O2)C=CC(=C4)C(=O)O

InChI

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