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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=CC(=C1)S(=O)(=O)C)C2=CC(OC2=O)(C)C

Isomeric SMILES

CCCCOC1=C(C=CC(=C1)S(=O)(=O)C)C2=CC(OC2=O)(C)C

InChI

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