4-methyl-2-[4-(2-methylpropoxy)phenyl]-3-oxidanylidene-hexanenitrile

Systemtic Name: 4-methyl-2-[4-(2-methylpropoxy)phenyl]-3-oxidanylidene-hexanenitrile Openeye Name: 2-(4-isobutoxyphenyl)-4-methyl-3-oxo-hexanenitrile CAS Name: 4-methyl-2-[4-(2-methylpropoxy)phenyl]-3-oxohexanenitrile IUPAC Name: 4-methyl-2-[4-(2-methylpropoxy)phenyl]-3-oxohexanenitrile Traditional Name: 2-(4-isobutoxyphenyl)-3-keto-4-methyl-hexanenitrile Formula: C17H23NO2 MolecularWeight: 273.37002

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)C(C#N)C1=CC=C(C=C1)OCC(C)C

Isomeric SMILES

CCC(C)C(=O)C(C#N)C1=CC=C(C=C1)OCC(C)C

InChI

InChI=1S/C17H23NO2/c1-5-13(4)17(19)16(10-18)14-6-8-15(9-7-14)20-11-12(2)3/h6-9,12-13,16H,5,11H2,1-4H3