1-(3-bromanyl-5-tert-butyl-2,3-dihydrothiophen-2-yl)-3,3-dimethyl-butan-2-one

Systemtic Name: 1-(3-bromanyl-5-tert-butyl-2,3-dihydrothiophen-2-yl)-3,3-dimethyl-butan-2-one Openeye Name: 1-(3-bromo-5-tert-butyl-2,3-dihydrothiophen-2-yl)-3,3-dimethyl-butan-2-one CAS Name: 1-(3-bromo-5-tert-butyl-2,3-dihydrothiophen-2-yl)-3,3-dimethyl-2-butanone IUPAC Name: 1-(3-bromo-5-tert-butyl-2,3-dihydrothiophen-2-yl)-3,3-dimethylbutan-2-one Traditional Name: 1-(3-bromo-5-tert-butyl-2,3-dihydrothiophen-2-yl)-3,3-dimethyl-butan-2-one Formula: C14H23BrOS MolecularWeight: 319.30082

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(C(S1)CC(=O)C(C)(C)C)Br

Isomeric SMILES

CC(C)(C)C1=CC(C(S1)CC(=O)C(C)(C)C)Br

InChI

InChI=1S/C14H23BrOS/c1-13(2,3)11(16)8-10-9(15)7-12(17-10)14(4,5)6/h7,9-10H,8H2,1-6H3