6-[(2-iodanylphenyl)methyl]-8,8-dimethyl-4-methylidene-6-methylsulfanyl-bicyclo[3.2.1]octan-7-one

Systemtic Name: 6-[(2-iodanylphenyl)methyl]-8,8-dimethyl-4-methylidene-6-methylsulfanyl-bicyclo[3.2.1]octan-7-one Openeye Name: 6-[(2-iodophenyl)methyl]-8,8-dimethyl-4-methylene-6-methylsulfanyl-bicyclo[3.2.1]octan-7-one CAS Name: 6-[(2-iodophenyl)methyl]-8,8-dimethyl-4-methylene-6-(methylthio)-7-bicyclo[3.2.1]octanone IUPAC Name: 6-[(2-iodophenyl)methyl]-8,8-dimethyl-4-methylidene-6-methylsulfanylbicyclo[3.2.1]octan-7-one Traditional Name: 6-(2-iodobenzyl)-8,8-dimethyl-4-methylene-6-(methylthio)bicyclo[3.2.1]octan-7-one Formula: C19H23IOS MolecularWeight: 426.35479

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CCC(=C)C1C(C2=O)(CC3=CC=CC=C3I)SC)C

Isomeric SMILES

CC1(C2CCC(=C)C1C(C2=O)(CC3=CC=CC=C3I)SC)C

InChI

InChI=1S/C19H23IOS/c1-12-9-10-14-17(21)19(22-4,16(12)18(14,2)3)11-13-7-5-6-8-15(13)20/h5-8,14,16H,1,9-11H2,2-4H3