3-bromanyl-5-tert-butyl-4-oxidanyl-benzenecarbonitrile

Systemtic Name: 3-bromanyl-5-tert-butyl-4-oxidanyl-benzenecarbonitrile Openeye Name: 3-bromo-5-tert-butyl-4-hydroxy-benzonitrile CAS Name: 3-bromo-5-tert-butyl-4-hydroxybenzonitrile IUPAC Name: 3-bromo-5-tert-butyl-4-hydroxybenzonitrile Traditional Name: 3-bromo-5-tert-butyl-4-hydroxy-benzonitrile Formula: C11H12BrNO MolecularWeight: 254.12308

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12BrNO/c1-11(2,3)8-4-7(6-13)5-9(12)10(8)14/h4-5,14H,1-3H3