(phenylmethyl) N-[1-cyano-3-(4-methylsulfonylphenyl)-1-oxidanyl-propan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-cyano-3-(4-methylsulfonylphenyl)-1-oxidanyl-propan-2-yl]carbamate Openeye Name: benzyl N-[2-cyano-2-hydroxy-1-[(4-methylsulfonylphenyl)methyl]ethyl]carbamate CAS Name: N-[1-cyano-1-hydroxy-3-(4-methylsulfonylphenyl)propan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-cyano-1-hydroxy-3-(4-methylsulfonylphenyl)propan-2-yl]carbamate Traditional Name: N-[2-cyano-2-hydroxy-1-(4-mesylbenzyl)ethyl]carbamic acid benzyl ester Formula: C19H20N2O5S MolecularWeight: 388.4375

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)CC(C(C#N)O)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)CC(C(C#N)O)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C19H20N2O5S/c1-27(24,25)16-9-7-14(8-10-16)11-17(18(22)12-20)21-19(23)26-13-15-5-3-2-4-6-15/h2-10,17-18,22H,11,13H2,1H3,(H,21,23)