(2R,3S)-4,4-dimethyl-2-oxidanyl-3-(phenylmethyl)hex-5-enenitrile

Systemtic Name: (2R,3S)-4,4-dimethyl-2-oxidanyl-3-(phenylmethyl)hex-5-enenitrile Openeye Name: (2R,3S)-3-benzyl-2-hydroxy-4,4-dimethyl-hex-5-enenitrile CAS Name: (2R,3S)-2-hydroxy-4,4-dimethyl-3-(phenylmethyl)-5-hexenenitrile IUPAC Name: (2R,3S)-3-benzyl-2-hydroxy-4,4-dimethylhex-5-enenitrile Traditional Name: (2R,3S)-3-benzyl-2-hydroxy-4,4-dimethyl-hex-5-enenitrile Formula: C15H19NO MolecularWeight: 229.31746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C=C)C(CC1=CC=CC=C1)C(C#N)O

Isomeric SMILES

CC(C)(C=C)[C@H](CC1=CC=CC=C1)[C@H](C#N)O

InChI

InChI=1S/C15H19NO/c1-4-15(2,3)13(14(17)11-16)10-12-8-6-5-7-9-12/h4-9,13-14,17H,1,10H2,2-3H3/t13-,14+/m1/s1