4,4-dimethyl-5-oxidanyl-5-phenyl-pentanenitrile

Systemtic Name: 4,4-dimethyl-5-oxidanyl-5-phenyl-pentanenitrile Openeye Name: 5-hydroxy-4,4-dimethyl-5-phenyl-pentanenitrile CAS Name: 5-hydroxy-4,4-dimethyl-5-phenylpentanenitrile IUPAC Name: 5-hydroxy-4,4-dimethyl-5-phenylpentanenitrile Traditional Name: 5-hydroxy-4,4-dimethyl-5-phenyl-valeronitrile Formula: C13H17NO MolecularWeight: 203.28018

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO/c1-13(2,9-6-10-14)12(15)11-7-4-3-5-8-11/h3-5,7-8,12,15H,6,9H2,1-2H3