4-[4-oxidanyl-3,5-di(propan-2-yl)phenyl]carbonylbenzenecarbonitrile

Systemtic Name: 4-[4-oxidanyl-3,5-di(propan-2-yl)phenyl]carbonylbenzenecarbonitrile Openeye Name: 4-(4-hydroxy-3,5-diisopropyl-benzoyl)benzonitrile CAS Name: 4-[[4-hydroxy-3,5-di(propan-2-yl)phenyl]-oxomethyl]benzonitrile IUPAC Name: 4-[4-hydroxy-3,5-di(propan-2-yl)benzoyl]benzonitrile Traditional Name: 4-(4-hydroxy-3,5-diisopropyl-benzoyl)benzonitrile Formula: C20H21NO2 MolecularWeight: 307.38624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H21NO2/c1-12(2)17-9-16(10-18(13(3)4)20(17)23)19(22)15-7-5-14(11-21)6-8-15/h5-10,12-13,23H,1-4H3