(4R,5R)-5-methyl-4-oxidanyl-7-phenylmethoxy-heptanenitrile

Systemtic Name: (4R,5R)-5-methyl-4-oxidanyl-7-phenylmethoxy-heptanenitrile Openeye Name: (4R,5R)-7-benzyloxy-4-hydroxy-5-methyl-heptanenitrile CAS Name: (4R,5R)-4-hydroxy-5-methyl-7-phenylmethoxyheptanenitrile IUPAC Name: (4R,5R)-4-hydroxy-5-methyl-7-phenylmethoxyheptanenitrile Traditional Name: (4R,5R)-7-benzoxy-4-hydroxy-5-methyl-enanthonitrile Formula: C15H21NO2 MolecularWeight: 247.33274

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21NO2/c1-13(15(17)8-5-10-16)9-11-18-12-14-6-3-2-4-7-14/h2-4,6-7,13,15,17H,5,8-9,11-12H2,1H3/t13-,15-/m1/s1