4-[3-(4-butylphenyl)-5,5-dimethyl-4-oxidanylidene-furan-2-yl]benzenesulfonamide

Systemtic Name: 4-[3-(4-butylphenyl)-5,5-dimethyl-4-oxidanylidene-furan-2-yl]benzenesulfonamide Openeye Name: 4-[3-(4-butylphenyl)-5,5-dimethyl-4-oxo-2-furyl]benzenesulfonamide CAS Name: 4-[3-(4-butylphenyl)-5,5-dimethyl-4-oxo-2-furanyl]benzenesulfonamide IUPAC Name: 4-[3-(4-butylphenyl)-5,5-dimethyl-4-oxofuran-2-yl]benzenesulfonamide Traditional Name: 4-[3-(4-butylphenyl)-4-keto-5,5-dimethyl-2-furyl]benzenesulfonamide Formula: C22H25NO4S MolecularWeight: 399.5032

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=C(OC(C2=O)(C)C)C3=CC=C(C=C3)S(=O)(=O)N

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=C(OC(C2=O)(C)C)C3=CC=C(C=C3)S(=O)(=O)N

InChI

InChI=1S/C22H25NO4S/c1-4-5-6-15-7-9-16(10-8-15)19-20(27-22(2,3)21(19)24)17-11-13-18(14-12-17)28(23,25)26/h7-14H,4-6H2,1-3H3,(H2,23,25,26)