methyl (1R,2S,3S,4S)-3-(4-methylphenyl)sulfinylbicyclo[2.2.1]hept-5-ene-2-carboxylate

Systemtic Name: methyl (1R,2S,3S,4S)-3-(4-methylphenyl)sulfinylbicyclo[2.2.1]hept-5-ene-2-carboxylate Openeye Name: methyl (1R,2S,3S,4S)-3-(p-tolylsulfinyl)bicyclo[2.2.1]hept-5-ene-2-carboxylate CAS Name: (1R,2S,3S,4S)-3-(4-methylphenyl)sulfinyl-2-bicyclo[2.2.1]hept-5-enecarboxylic acid methyl ester IUPAC Name: methyl (1R,2S,3S,4S)-3-(4-methylphenyl)sulfinylbicyclo[2.2.1]hept-5-ene-2-carboxylate Traditional Name: (1R,2S,3S,4S)-3-(p-tolylsulfinyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid methyl ester Formula: C16H18O3S MolecularWeight: 290.37732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)C2C3CC(C2C(=O)OC)C=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)[C@H]2[C@H]3C[C@@H]([C@H]2C(=O)OC)C=C3

InChI

InChI=1S/C16H18O3S/c1-10-3-7-13(8-4-10)20(18)15-12-6-5-11(9-12)14(15)16(17)19-2/h3-8,11-12,14-15H,9H2,1-2H3/t11-,12+,14+,15-,20?/m0/s1