3-(3-fluorophenyl)-5-methyl-4-(4-methylsulfonylphenyl)-5-propyl-furan-2-one

Systemtic Name: 3-(3-fluorophenyl)-5-methyl-4-(4-methylsulfonylphenyl)-5-propyl-furan-2-one Openeye Name: 3-(3-fluorophenyl)-5-methyl-4-(4-methylsulfonylphenyl)-5-propyl-furan-2-one CAS Name: 3-(3-fluorophenyl)-5-methyl-4-(4-methylsulfonylphenyl)-5-propyl-2-furanone IUPAC Name: 3-(3-fluorophenyl)-5-methyl-4-(4-methylsulfonylphenyl)-5-propylfuran-2-one Traditional Name: 3-(3-fluorophenyl)-4-(4-mesylphenyl)-5-methyl-5-propyl-furan-2-one Formula: C21H21FO4S MolecularWeight: 388.452443

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C(=C(C(=O)O1)C2=CC(=CC=C2)F)C3=CC=C(C=C3)S(=O)(=O)C)C

Isomeric SMILES

CCCC1(C(=C(C(=O)O1)C2=CC(=CC=C2)F)C3=CC=C(C=C3)S(=O)(=O)C)C

InChI

InChI=1S/C21H21FO4S/c1-4-12-21(2)19(14-8-10-17(11-9-14)27(3,24)25)18(20(23)26-21)15-6-5-7-16(22)13-15/h5-11,13H,4,12H2,1-3H3