2-[4-(2-methylpropoxy)phenyl]-3-oxidanylidene-heptanenitrile

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23NO2/c1-4-5-6-17(19)16(11-18)14-7-9-15(10-8-14)20-12-13(2)3/h7-10,13,16H,4-6,12H2,1-3H3