[(2E)-7,7-dimethyl-2-[(4-methylphenyl)methylidene]-3-oxidanylidene-4-bicyclo[2.2.1]heptanyl]methanesulfonic acid

Systemtic Name: [(2E)-7,7-dimethyl-2-[(4-methylphenyl)methylidene]-3-oxidanylidene-4-bicyclo[2.2.1]heptanyl]methanesulfonic acid Openeye Name: [(3E)-7,7-dimethyl-2-oxo-3-(p-tolylmethylene)norbornan-1-yl]methanesulfonic acid CAS Name: [(2E)-7,7-dimethyl-2-[(4-methylphenyl)methylidene]-3-oxo-4-bicyclo[2.2.1]heptanyl]methanesulfonic acid IUPAC Name: [(2E)-7,7-dimethyl-2-[(4-methylphenyl)methylidene]-3-oxo-4-bicyclo[2.2.1]heptanyl]methanesulfonic acid Traditional Name: [(3E)-2-keto-7,7-dimethyl-3-(4-methylbenzylidene)norbornan-1-yl]methanesulfonic acid Formula: C18H22O4S MolecularWeight: 334.42988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C=C2C3CCC(C2=O)(C3(C)C)CS(=O)(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)/C=C/2\C3CCC(C2=O)(C3(C)C)CS(=O)(=O)O

InChI

InChI=1S/C18H22O4S/c1-12-4-6-13(7-5-12)10-14-15-8-9-18(16(14)19,17(15,2)3)11-23(20,21)22/h4-7,10,15H,8-9,11H2,1-3H3,(H,20,21,22)/b14-10+