4-(3,5-ditert-butyl-4-oxidanyl-phenyl)carbonylbenzenecarbonitrile

Systemtic Name: 4-(3,5-ditert-butyl-4-oxidanyl-phenyl)carbonylbenzenecarbonitrile Openeye Name: 4-(3,5-ditert-butyl-4-hydroxy-benzoyl)benzonitrile CAS Name: 4-[(3,5-ditert-butyl-4-hydroxyphenyl)-oxomethyl]benzonitrile IUPAC Name: 4-(3,5-ditert-butyl-4-hydroxybenzoyl)benzonitrile Traditional Name: 4-(3,5-ditert-butyl-4-hydroxy-benzoyl)benzonitrile Formula: C22H25NO2 MolecularWeight: 335.4394

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)C2=CC=C(C=C2)C#N

Isomeric SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(=O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C22H25NO2/c1-21(2,3)17-11-16(12-18(20(17)25)22(4,5)6)19(24)15-9-7-14(13-23)8-10-15/h7-12,25H,1-6H3