4-bromanyl-3-(2,2-dimethyl-1-oxidanyl-propyl)benzenecarbonitrile

Systemtic Name: 4-bromanyl-3-(2,2-dimethyl-1-oxidanyl-propyl)benzenecarbonitrile Openeye Name: 4-bromo-3-(1-hydroxy-2,2-dimethyl-propyl)benzonitrile CAS Name: 4-bromo-3-(1-hydroxy-2,2-dimethylpropyl)benzonitrile IUPAC Name: 4-bromo-3-(1-hydroxy-2,2-dimethylpropyl)benzonitrile Traditional Name: 4-bromo-3-(1-hydroxy-2,2-dimethyl-propyl)benzonitrile Formula: C12H14BrNO MolecularWeight: 268.14966

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H14BrNO/c1-12(2,3)11(15)9-6-8(7-14)4-5-10(9)13/h4-6,11,15H,1-3H3