(2S)-2-(2-bromanyl-4,6-ditert-butyl-phenoxy)propanenitrile

Systemtic Name: (2S)-2-(2-bromanyl-4,6-ditert-butyl-phenoxy)propanenitrile Openeye Name: (2S)-2-(2-bromo-4,6-ditert-butyl-phenoxy)propanenitrile CAS Name: (2S)-2-(2-bromo-4,6-ditert-butylphenoxy)propanenitrile IUPAC Name: (2S)-2-(2-bromo-4,6-ditert-butylphenoxy)propanenitrile Traditional Name: (2S)-2-(2-bromo-4,6-ditert-butyl-phenoxy)propionitrile Formula: C17H24BrNO MolecularWeight: 338.28256

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)OC1=C(C=C(C=C1Br)C(C)(C)C)C(C)(C)C

Isomeric SMILES

C[C@@H](C#N)OC1=C(C=C(C=C1Br)C(C)(C)C)C(C)(C)C

InChI

InChI=1S/C17H24BrNO/c1-11(10-19)20-15-13(17(5,6)7)8-12(9-14(15)18)16(2,3)4/h8-9,11H,1-7H3/t11-/m0/s1