2-(4-methylsulfinylphenyl)-2-oxidanyl-pentanenitrile

Systemtic Name: 2-(4-methylsulfinylphenyl)-2-oxidanyl-pentanenitrile Openeye Name: 2-hydroxy-2-(4-methylsulfinylphenyl)pentanenitrile CAS Name: 2-hydroxy-2-(4-methylsulfinylphenyl)pentanenitrile IUPAC Name: 2-hydroxy-2-(4-methylsulfinylphenyl)pentanenitrile Traditional Name: 2-hydroxy-2-(4-methylsulfinylphenyl)valeronitrile Formula: C12H15NO2S MolecularWeight: 237.318

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C#N)(C1=CC=C(C=C1)S(=O)C)O

Isomeric SMILES

CCCC(C#N)(C1=CC=C(C=C1)S(=O)C)O

InChI

InChI=1S/C12H15NO2S/c1-3-8-12(14,9-13)10-4-6-11(7-5-10)16(2)15/h4-7,14H,3,8H2,1-2H3