(3S,4S)-3-methyl-4-oxidanyl-6-phenylmethoxy-hexanenitrile

Systemtic Name: (3S,4S)-3-methyl-4-oxidanyl-6-phenylmethoxy-hexanenitrile Openeye Name: (3S,4S)-6-benzyloxy-4-hydroxy-3-methyl-hexanenitrile CAS Name: (3S,4S)-4-hydroxy-3-methyl-6-phenylmethoxyhexanenitrile IUPAC Name: (3S,4S)-4-hydroxy-3-methyl-6-phenylmethoxyhexanenitrile Traditional Name: (3S,4S)-6-benzoxy-4-hydroxy-3-methyl-hexanenitrile Formula: C14H19NO2 MolecularWeight: 233.30616

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC#N)C(CCOCC1=CC=CC=C1)O

Isomeric SMILES

C[C@@H](CC#N)[C@H](CCOCC1=CC=CC=C1)O

InChI

InChI=1S/C14H19NO2/c1-12(7-9-15)14(16)8-10-17-11-13-5-3-2-4-6-13/h2-6,12,14,16H,7-8,10-11H2,1H3/t12-,14-/m0/s1