[(2R)-1-(4-cyanophenyl)-1-oxidanylidene-propan-2-yl] methanesulfonate

Systemtic Name: [(2R)-1-(4-cyanophenyl)-1-oxidanylidene-propan-2-yl] methanesulfonate Openeye Name: [(1R)-2-(4-cyanophenyl)-1-methyl-2-oxo-ethyl] methanesulfonate CAS Name: methanesulfonic acid [(2R)-1-(4-cyanophenyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-(4-cyanophenyl)-1-oxopropan-2-yl] methanesulfonate Traditional Name: methanesulfonic acid [(1R)-2-(4-cyanophenyl)-2-keto-1-methyl-ethyl] ester Formula: C11H11NO4S MolecularWeight: 253.27434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)C#N)OS(=O)(=O)C

Isomeric SMILES

C[C@H](C(=O)C1=CC=C(C=C1)C#N)OS(=O)(=O)C

InChI

InChI=1S/C11H11NO4S/c1-8(16-17(2,14)15)11(13)10-5-3-9(7-12)4-6-10/h3-6,8H,1-2H3/t8-/m1/s1