4-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]butanenitrile

Systemtic Name: 4-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]butanenitrile Openeye Name: 4-[4-(1,1,3,3-tetramethylbutyl)phenoxy]butanenitrile CAS Name: 4-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]butanenitrile IUPAC Name: 4-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]butanenitrile Traditional Name: 4-[4-(1,1,3,3-tetramethylbutyl)phenoxy]butyronitrile Formula: C18H27NO MolecularWeight: 273.41308

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H27NO/c1-17(2,3)14-18(4,5)15-8-10-16(11-9-15)20-13-7-6-12-19/h8-11H,6-7,13-14H2,1-5H3