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

Systemtic Name: 4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanenitrile Openeye Name: 4-[2,4-bis(1,1-dimethylpropyl)phenoxy]butanenitrile CAS Name: 4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanenitrile IUPAC Name: 4-[2,4-bis(2-methylbutan-2-yl)phenoxy]butanenitrile Traditional Name: 4-(2,4-ditert-amylphenoxy)butyronitrile Formula: C20H31NO MolecularWeight: 301.46624

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H31NO/c1-7-19(3,4)16-11-12-18(22-14-10-9-13-21)17(15-16)20(5,6)8-2/h11-12,15H,7-10,14H2,1-6H3