3-[2,4-bis(2-methylbutan-2-yl)phenoxy]propanenitrile

Systemtic Name: 3-[2,4-bis(2-methylbutan-2-yl)phenoxy]propanenitrile Openeye Name: 3-[2,4-bis(1,1-dimethylpropyl)phenoxy]propanenitrile CAS Name: 3-[2,4-bis(2-methylbutan-2-yl)phenoxy]propanenitrile IUPAC Name: 3-[2,4-bis(2-methylbutan-2-yl)phenoxy]propanenitrile Traditional Name: 3-(2,4-ditert-amylphenoxy)propionitrile Formula: C19H29NO MolecularWeight: 287.43966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)OCCC#N)C(C)(C)CC

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)OCCC#N)C(C)(C)CC

InChI

InChI=1S/C19H29NO/c1-7-18(3,4)15-10-11-17(21-13-9-12-20)16(14-15)19(5,6)8-2/h10-11,14H,7-9,13H2,1-6H3