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

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

Systemtic Name:4-bromanyl-2,2-dimethyl-5-(4-methylsulfonylphenyl)furan-3-one
Openeye Name:4-bromo-2,2-dimethyl-5-(4-methylsulfonylphenyl)furan-3-one
CAS Name:4-bromo-2,2-dimethyl-5-(4-methylsulfonylphenyl)-3-furanone
IUPAC Name:4-bromo-2,2-dimethyl-5-(4-methylsulfonylphenyl)furan-3-one
Traditional Name:4-bromo-5-(4-mesylphenyl)-2,2-dimethyl-furan-3-one
Formula: C13H13BrO4S
MolecularWeight: 345.20892
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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)C(=C(O1)C2=CC=C(C=C2)S(=O)(=O)C)Br)C


Isomeric SMILES

CC1(C(=O)C(=C(O1)C2=CC=C(C=C2)S(=O)(=O)C)Br)C


InChI

InChI=1S/C13H13BrO4S/c1-13(2)12(15)10(14)11(18-13)8-4-6-9(7-5-8)19(3,16)17/h4-7H,1-3H3


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