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2-(6-oxidanyl-2,3,4,4a,9,9a-hexahydro-1H-xanthen-9-yl)benzoic acid

2-(6-oxidanyl-2,3,4,4a,9,9a-hexahydro-1H-xanthen-9-yl)benzoic acid

Systemtic Name:2-(6-oxidanyl-2,3,4,4a,9,9a-hexahydro-1H-xanthen-9-yl)benzoic acid
Openeye Name:2-(6-hydroxy-2,3,4,4a,9,9a-hexahydro-1H-xanthen-9-yl)benzoic acid
CAS Name:2-(6-hydroxy-2,3,4,4a,9,9a-hexahydro-1H-xanthen-9-yl)benzoic acid
IUPAC Name:2-(6-hydroxy-2,3,4,4a,9,9a-hexahydro-1H-xanthen-9-yl)benzoic acid
Traditional Name:2-(6-hydroxy-2,3,4,4a,9,9a-hexahydro-1H-xanthen-9-yl)benzoic acid
Formula: C20H20O4
MolecularWeight: 324.3704
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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2C(C1)C(C3=C(O2)C=C(C=C3)O)C4=CC=CC=C4C(=O)O


Isomeric SMILES

C1CCC2C(C1)C(C3=C(O2)C=C(C=C3)O)C4=CC=CC=C4C(=O)O


InChI

InChI=1S/C20H20O4/c21-12-9-10-16-18(11-12)24-17-8-4-3-7-15(17)19(16)13-5-1-2-6-14(13)20(22)23/h1-2,5-6,9-11,15,17,19,21H,3-4,7-8H2,(H,22,23)


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