4-[(1S,2R)-2-methyl-1-oxidanyl-2-(phenylsulfonylmethyl)but-3-enyl]benzenecarbonitrile

Systemtic Name: 4-[(1S,2R)-2-methyl-1-oxidanyl-2-(phenylsulfonylmethyl)but-3-enyl]benzenecarbonitrile Openeye Name: 4-[(1S,2R)-2-(benzenesulfonylmethyl)-1-hydroxy-2-methyl-but-3-enyl]benzonitrile CAS Name: 4-[(1S,2R)-2-(benzenesulfonylmethyl)-1-hydroxy-2-methylbut-3-enyl]benzonitrile IUPAC Name: 4-[(1S,2R)-2-(benzenesulfonylmethyl)-1-hydroxy-2-methylbut-3-enyl]benzonitrile Traditional Name: 4-[(1S,2R)-2-(besylmethyl)-1-hydroxy-2-methyl-but-3-enyl]benzonitrile Formula: C19H19NO3S MolecularWeight: 341.42406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@](CS(=O)(=O)C1=CC=CC=C1)(C=C)[C@H](C2=CC=C(C=C2)C#N)O

InChI

InChI=1S/C19H19NO3S/c1-3-19(2,14-24(22,23)17-7-5-4-6-8-17)18(21)16-11-9-15(13-20)10-12-16/h3-12,18,21H,1,14H2,2H3/t18-,19-/m0/s1