(6,6-dimethyl-4-methylidene-3-bicyclo[3.1.1]heptanyl)methyl 4-methylbenzenesulfonate

Systemtic Name: (6,6-dimethyl-4-methylidene-3-bicyclo[3.1.1]heptanyl)methyl 4-methylbenzenesulfonate Openeye Name: (6,6-dimethyl-2-methylene-norpinan-3-yl)methyl 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid (6,6-dimethyl-4-methylene-3-bicyclo[3.1.1]heptanyl)methyl ester IUPAC Name: (6,6-dimethyl-4-methylidene-3-bicyclo[3.1.1]heptanyl)methyl 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid (6,6-dimethyl-2-methylene-norpinan-3-yl)methyl ester Formula: C18H24O3S MolecularWeight: 320.44636

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)OCC2CC3CC(C2=C)C3(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)OCC2CC3CC(C2=C)C3(C)C

InChI

InChI=1S/C18H24O3S/c1-12-5-7-16(8-6-12)22(19,20)21-11-14-9-15-10-17(13(14)2)18(15,3)4/h5-8,14-15,17H,2,9-11H2,1,3-4H3