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

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

Systemtic Name:6-[cyclobutyl(oxidanyl)methyl]-9-oxidanylidene-xanthene-2-carboxylic acid
Openeye Name:6-[cyclobutyl(hydroxy)methyl]-9-oxo-xanthene-2-carboxylic acid
CAS Name:6-[cyclobutyl(hydroxy)methyl]-9-oxo-2-xanthenecarboxylic acid
IUPAC Name:6-[cyclobutyl(hydroxy)methyl]-9-oxoxanthene-2-carboxylic acid
Traditional Name:6-[cyclobutyl(hydroxy)methyl]-9-keto-xanthene-2-carboxylic acid
Formula: C19H16O5
MolecularWeight: 324.32734
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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C(C2=CC3=C(C=C2)C(=O)C4=C(O3)C=CC(=C4)C(=O)O)O


Isomeric SMILES

C1CC(C1)C(C2=CC3=C(C=C2)C(=O)C4=C(O3)C=CC(=C4)C(=O)O)O


InChI

InChI=1S/C19H16O5/c20-17(10-2-1-3-10)11-4-6-13-16(9-11)24-15-7-5-12(19(22)23)8-14(15)18(13)21/h4-10,17,20H,1-3H2,(H,22,23)


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