[(1R,2R)-2-cyanocyclopropyl]methyl (3,5-dimethylphenyl)methanesulfonate

Systemtic Name: [(1R,2R)-2-cyanocyclopropyl]methyl (3,5-dimethylphenyl)methanesulfonate Openeye Name: [(1R,2R)-2-cyanocyclopropyl]methyl (3,5-dimethylphenyl)methanesulfonate CAS Name: (3,5-dimethylphenyl)methanesulfonic acid [(1R,2R)-2-cyanocyclopropyl]methyl ester IUPAC Name: [(1R,2R)-2-cyanocyclopropyl]methyl (3,5-dimethylphenyl)methanesulfonate Traditional Name: (3,5-dimethylphenyl)methanesulfonic acid [(1R,2R)-2-cyanocyclopropyl]methyl ester Formula: C14H17NO3S MolecularWeight: 279.35468

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CS(=O)(=O)OCC2CC2C#N)C

Isomeric SMILES

CC1=CC(=CC(=C1)CS(=O)(=O)OC[C@@H]2C[C@H]2C#N)C

InChI

InChI=1S/C14H17NO3S/c1-10-3-11(2)5-12(4-10)9-19(16,17)18-8-14-6-13(14)7-15/h3-5,13-14H,6,8-9H2,1-2H3/t13-,14-/m0/s1