methyl (1R,3R,4S)-3-methylsulfonyl-2-propan-2-ylidene-bicyclo[2.2.1]hept-5-ene-3-carboxylate

Systemtic Name: methyl (1R,3R,4S)-3-methylsulfonyl-2-propan-2-ylidene-bicyclo[2.2.1]hept-5-ene-3-carboxylate Openeye Name: methyl (1R,3R,4S)-2-isopropylidene-3-methylsulfonyl-bicyclo[2.2.1]hept-5-ene-3-carboxylate CAS Name: (1R,3R,4S)-3-methylsulfonyl-2-propan-2-ylidene-3-bicyclo[2.2.1]hept-5-enecarboxylic acid methyl ester IUPAC Name: methyl (1R,3R,4S)-3-methylsulfonyl-2-propan-2-ylidenebicyclo[2.2.1]hept-5-ene-3-carboxylate Traditional Name: (1R,3R,4S)-2-isopropylidene-3-mesyl-bicyclo[2.2.1]hept-5-ene-3-carboxylic acid methyl ester Formula: C13H18O4S MolecularWeight: 270.34462

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C2CC(C1(C(=O)OC)S(=O)(=O)C)C=C2)C

Isomeric SMILES

CC(=C1[C@@H]2C[C@H]([C@@]1(C(=O)OC)S(=O)(=O)C)C=C2)C

InChI

InChI=1S/C13H18O4S/c1-8(2)11-9-5-6-10(7-9)13(11,12(14)17-3)18(4,15)16/h5-6,9-10H,7H2,1-4H3/t9-,10+,13+/m0/s1