(3S,4R)-3,4-bis(oxidanyl)-5-phenylmethoxy-pentanenitrile

Systemtic Name: (3S,4R)-3,4-bis(oxidanyl)-5-phenylmethoxy-pentanenitrile Openeye Name: (3S,4R)-5-benzyloxy-3,4-dihydroxy-pentanenitrile CAS Name: (3S,4R)-3,4-dihydroxy-5-phenylmethoxypentanenitrile IUPAC Name: (3S,4R)-3,4-dihydroxy-5-phenylmethoxypentanenitrile Traditional Name: (3S,4R)-5-benzoxy-3,4-dihydroxy-valeronitrile Formula: C12H15NO3 MolecularWeight: 221.2524

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15NO3/c13-7-6-11(14)12(15)9-16-8-10-4-2-1-3-5-10/h1-5,11-12,14-15H,6,8-9H2/t11-,12+/m0/s1