(2R,3S)-5-methyl-2-oxidanyl-3-phenylmethoxy-hexanenitrile

Systemtic Name: (2R,3S)-5-methyl-2-oxidanyl-3-phenylmethoxy-hexanenitrile Openeye Name: (2R,3S)-3-benzyloxy-2-hydroxy-5-methyl-hexanenitrile CAS Name: (2R,3S)-2-hydroxy-5-methyl-3-phenylmethoxyhexanenitrile IUPAC Name: (2R,3S)-2-hydroxy-5-methyl-3-phenylmethoxyhexanenitrile Traditional Name: (2R,3S)-3-benzoxy-2-hydroxy-5-methyl-hexanenitrile Formula: C14H19NO2 MolecularWeight: 233.30616

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(C#N)O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)C[C@@H]([C@@H](C#N)O)OCC1=CC=CC=C1

InChI

InChI=1S/C14H19NO2/c1-11(2)8-14(13(16)9-15)17-10-12-6-4-3-5-7-12/h3-7,11,13-14,16H,8,10H2,1-2H3/t13-,14+/m1/s1