5-oxidanyl-2-phenyl-2-propan-2-yl-octanenitrile

Systemtic Name: 5-oxidanyl-2-phenyl-2-propan-2-yl-octanenitrile Openeye Name: 5-hydroxy-2-isopropyl-2-phenyl-octanenitrile CAS Name: 5-hydroxy-2-phenyl-2-propan-2-yloctanenitrile IUPAC Name: 5-hydroxy-2-phenyl-2-propan-2-yloctanenitrile Traditional Name: 5-hydroxy-2-isopropyl-2-phenyl-caprylonitrile Formula: C17H25NO MolecularWeight: 259.3865

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25NO/c1-4-8-16(19)11-12-17(13-18,14(2)3)15-9-6-5-7-10-15/h5-7,9-10,14,16,19H,4,8,11-12H2,1-3H3