(4-tert-butylphenyl) (7,7-dimethyl-3-oxidanylidene-4-bicyclo[2.2.1]heptanyl)methanesulfonate

Systemtic Name: (4-tert-butylphenyl) (7,7-dimethyl-3-oxidanylidene-4-bicyclo[2.2.1]heptanyl)methanesulfonate Openeye Name: (4-tert-butylphenyl) (7,7-dimethyl-2-oxo-norbornan-1-yl)methanesulfonate CAS Name: (7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanyl)methanesulfonic acid (4-tert-butylphenyl) ester IUPAC Name: (4-tert-butylphenyl) (7,7-dimethyl-3-oxo-4-bicyclo[2.2.1]heptanyl)methanesulfonate Traditional Name: (2-keto-7,7-dimethyl-norbornan-1-yl)methanesulfonic acid (4-tert-butylphenyl) ester Formula: C20H28O4S MolecularWeight: 364.49892

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2CCC1(C(=O)C2)CS(=O)(=O)OC3=CC=C(C=C3)C(C)(C)C)C

Isomeric SMILES

CC1(C2CCC1(C(=O)C2)CS(=O)(=O)OC3=CC=C(C=C3)C(C)(C)C)C

InChI

InChI=1S/C20H28O4S/c1-18(2,3)14-6-8-16(9-7-14)24-25(22,23)13-20-11-10-15(12-17(20)21)19(20,4)5/h6-9,15H,10-13H2,1-5H3