4-(4-tert-butylphenyl)-2,2-diethyl-5-(4-methylsulfonylphenyl)furan-3-one

Systemtic Name: 4-(4-tert-butylphenyl)-2,2-diethyl-5-(4-methylsulfonylphenyl)furan-3-one Openeye Name: 4-(4-tert-butylphenyl)-2,2-diethyl-5-(4-methylsulfonylphenyl)furan-3-one CAS Name: 4-(4-tert-butylphenyl)-2,2-diethyl-5-(4-methylsulfonylphenyl)-3-furanone IUPAC Name: 4-(4-tert-butylphenyl)-2,2-diethyl-5-(4-methylsulfonylphenyl)furan-3-one Traditional Name: 4-(4-tert-butylphenyl)-2,2-diethyl-5-(4-mesylphenyl)furan-3-one Formula: C25H30O4S MolecularWeight: 426.5683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(=O)C(=C(O1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=C(C=C3)C(C)(C)C)CC

Isomeric SMILES

CCC1(C(=O)C(=C(O1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=C(C=C3)C(C)(C)C)CC

InChI

InChI=1S/C25H30O4S/c1-7-25(8-2)23(26)21(17-9-13-19(14-10-17)24(3,4)5)22(29-25)18-11-15-20(16-12-18)30(6,27)28/h9-16H,7-8H2,1-6H3