(2S,4aS)-4a-butyl-2-(2-fluorophenyl)carbonyl-9-oxidanyl-3,4-dihydro-2H-xanthen-1-one

Systemtic Name: (2S,4aS)-4a-butyl-2-(2-fluorophenyl)carbonyl-9-oxidanyl-3,4-dihydro-2H-xanthen-1-one Openeye Name: (2S,4aS)-4a-butyl-2-(2-fluorobenzoyl)-9-hydroxy-3,4-dihydro-2H-xanthen-1-one CAS Name: (2S,4aS)-4a-butyl-2-[(2-fluorophenyl)-oxomethyl]-9-hydroxy-3,4-dihydro-2H-xanthen-1-one IUPAC Name: (2S,4aS)-4a-butyl-2-(2-fluorobenzoyl)-9-hydroxy-3,4-dihydro-2H-xanthen-1-one Traditional Name: (2S,4aS)-4a-butyl-2-(2-fluorobenzoyl)-9-hydroxy-3,4-dihydro-2H-xanthen-1-one Formula: C24H23FO4 MolecularWeight: 394.435423

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC12CCC(C(=O)C1=C(C3=CC=CC=C3O2)O)C(=O)C4=CC=CC=C4F

Isomeric SMILES

CCCC[C@]12CC[C@@H](C(=O)C1=C(C3=CC=CC=C3O2)O)C(=O)C4=CC=CC=C4F

InChI

InChI=1S/C24H23FO4/c1-2-3-13-24-14-12-17(21(26)15-8-4-6-10-18(15)25)23(28)20(24)22(27)16-9-5-7-11-19(16)29-24/h4-11,17,27H,2-3,12-14H2,1H3/t17-,24+/m1/s1