3-tert-butyl-5-(2-methylpropyl)-4-oxidanyl-benzenecarbonitrile

Systemtic Name: 3-tert-butyl-5-(2-methylpropyl)-4-oxidanyl-benzenecarbonitrile Openeye Name: 3-tert-butyl-4-hydroxy-5-isobutyl-benzonitrile CAS Name: 3-tert-butyl-4-hydroxy-5-(2-methylpropyl)benzonitrile IUPAC Name: 3-tert-butyl-4-hydroxy-5-(2-methylpropyl)benzonitrile Traditional Name: 3-tert-butyl-4-hydroxy-5-isobutyl-benzonitrile Formula: C15H21NO MolecularWeight: 231.33334

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H21NO/c1-10(2)6-12-7-11(9-16)8-13(14(12)17)15(3,4)5/h7-8,10,17H,6H2,1-5H3