N-[4-[3-(3-fluorophenyl)-5,5-dimethyl-4-oxidanylidene-furan-2-yl]phenyl]sulfonylbutanamide

Systemtic Name: N-[4-[3-(3-fluorophenyl)-5,5-dimethyl-4-oxidanylidene-furan-2-yl]phenyl]sulfonylbutanamide Openeye Name: N-[4-[3-(3-fluorophenyl)-5,5-dimethyl-4-oxo-2-furyl]phenyl]sulfonylbutanamide CAS Name: N-[4-[3-(3-fluorophenyl)-5,5-dimethyl-4-oxo-2-furanyl]phenyl]sulfonylbutanamide IUPAC Name: N-[4-[3-(3-fluorophenyl)-5,5-dimethyl-4-oxofuran-2-yl]phenyl]sulfonylbutanamide Traditional Name: N-[4-[3-(3-fluorophenyl)-4-keto-5,5-dimethyl-2-furyl]phenyl]sulfonylbutyramide Formula: C22H22FNO5S MolecularWeight: 431.477183

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)C(O2)(C)C)C3=CC(=CC=C3)F

Isomeric SMILES

CCCC(=O)NS(=O)(=O)C1=CC=C(C=C1)C2=C(C(=O)C(O2)(C)C)C3=CC(=CC=C3)F

InChI

InChI=1S/C22H22FNO5S/c1-4-6-18(25)24-30(27,28)17-11-9-14(10-12-17)20-19(21(26)22(2,3)29-20)15-7-5-8-16(23)13-15/h5,7-13H,4,6H2,1-3H3,(H,24,25)