5-bromanyl-3-methyl-2-oxidanyl-benzenecarbonitrile

Systemtic Name: 5-bromanyl-3-methyl-2-oxidanyl-benzenecarbonitrile Openeye Name: 5-bromo-2-hydroxy-3-methyl-benzonitrile CAS Name: 5-bromo-2-hydroxy-3-methylbenzonitrile IUPAC Name: 5-bromo-2-hydroxy-3-methylbenzonitrile Traditional Name: 5-bromo-2-hydroxy-3-methyl-benzonitrile Formula: C8H6BrNO MolecularWeight: 212.04334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H6BrNO/c1-5-2-7(9)3-6(4-10)8(5)11/h2-3,11H,1H3