3-butoxy-5,5-dimethyl-4-(4-methylsulfonylphenyl)furan-2-one

Systemtic Name: 3-butoxy-5,5-dimethyl-4-(4-methylsulfonylphenyl)furan-2-one Openeye Name: 3-butoxy-5,5-dimethyl-4-(4-methylsulfonylphenyl)furan-2-one CAS Name: 3-butoxy-5,5-dimethyl-4-(4-methylsulfonylphenyl)-2-furanone IUPAC Name: 3-butoxy-5,5-dimethyl-4-(4-methylsulfonylphenyl)furan-2-one Traditional Name: 3-butoxy-4-(4-mesylphenyl)-5,5-dimethyl-furan-2-one Formula: C17H22O5S MolecularWeight: 338.41858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C(OC1=O)(C)C)C2=CC=C(C=C2)S(=O)(=O)C

Isomeric SMILES

CCCCOC1=C(C(OC1=O)(C)C)C2=CC=C(C=C2)S(=O)(=O)C

InChI

InChI=1S/C17H22O5S/c1-5-6-11-21-15-14(17(2,3)22-16(15)18)12-7-9-13(10-8-12)23(4,19)20/h7-10H,5-6,11H2,1-4H3