3-bromanyl-5-methyl-4-oxidanyl-benzenecarbonitrile

Systemtic Name: 3-bromanyl-5-methyl-4-oxidanyl-benzenecarbonitrile Openeye Name: 3-bromo-4-hydroxy-5-methyl-benzonitrile CAS Name: 3-bromo-4-hydroxy-5-methylbenzonitrile IUPAC Name: 3-bromo-4-hydroxy-5-methylbenzonitrile Traditional Name: 3-bromo-4-hydroxy-5-methyl-benzonitrile Formula: C8H6BrNO MolecularWeight: 212.04334

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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