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6-[(4-methylphenyl)-oxidanyl-methyl]-9-oxidanylidene-xanthene-2-carboxylic acid

6-[(4-methylphenyl)-oxidanyl-methyl]-9-oxidanylidene-xanthene-2-carboxylic acid

Systemtic Name:6-[(4-methylphenyl)-oxidanyl-methyl]-9-oxidanylidene-xanthene-2-carboxylic acid
Openeye Name:6-[hydroxy(p-tolyl)methyl]-9-oxo-xanthene-2-carboxylic acid
CAS Name:6-[hydroxy-(4-methylphenyl)methyl]-9-oxo-2-xanthenecarboxylic acid
IUPAC Name:6-[hydroxy-(4-methylphenyl)methyl]-9-oxoxanthene-2-carboxylic acid
Traditional Name:6-[hydroxy(p-tolyl)methyl]-9-keto-xanthene-2-carboxylic acid
Formula: C22H16O5
MolecularWeight: 360.35944
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC3=C(C=C2)C(=O)C4=C(O3)C=CC(=C4)C(=O)O)O


Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC3=C(C=C2)C(=O)C4=C(O3)C=CC(=C4)C(=O)O)O


InChI

InChI=1S/C22H16O5/c1-12-2-4-13(5-3-12)20(23)14-6-8-16-19(11-14)27-18-9-7-15(22(25)26)10-17(18)21(16)24/h2-11,20,23H,1H3,(H,25,26)


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