1-butyl-1-(4-fluorophenyl)-3,3a,4,6,7,7a-hexahydro-2-benzofuran-5-one

Systemtic Name: 1-butyl-1-(4-fluorophenyl)-3,3a,4,6,7,7a-hexahydro-2-benzofuran-5-one Openeye Name: 1-butyl-1-(4-fluorophenyl)-3,3a,4,6,7,7a-hexahydroisobenzofuran-5-one CAS Name: 1-butyl-1-(4-fluorophenyl)-3,3a,4,6,7,7a-hexahydroisobenzofuran-5-one IUPAC Name: 1-butyl-1-(4-fluorophenyl)-3,3a,4,6,7,7a-hexahydro-2-benzofuran-5-one Traditional Name: 1-butyl-1-(4-fluorophenyl)-3,3a,4,6,7,7a-hexahydroisobenzofuran-5-one Formula: C18H23FO2 MolecularWeight: 290.372423

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C2CCC(=O)CC2CO1)C3=CC=C(C=C3)F

Isomeric SMILES

CCCCC1(C2CCC(=O)CC2CO1)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H23FO2/c1-2-3-10-18(14-4-6-15(19)7-5-14)17-9-8-16(20)11-13(17)12-21-18/h4-7,13,17H,2-3,8-12H2,1H3