5-ethoxy-2-[4-(2-methylpropoxy)phenyl]-3-oxidanylidene-pentanenitrile

Systemtic Name: 5-ethoxy-2-[4-(2-methylpropoxy)phenyl]-3-oxidanylidene-pentanenitrile Openeye Name: 5-ethoxy-2-(4-isobutoxyphenyl)-3-oxo-pentanenitrile CAS Name: 5-ethoxy-2-[4-(2-methylpropoxy)phenyl]-3-oxopentanenitrile IUPAC Name: 5-ethoxy-2-[4-(2-methylpropoxy)phenyl]-3-oxopentanenitrile Traditional Name: 5-ethoxy-2-(4-isobutoxyphenyl)-3-keto-valeronitrile Formula: C17H23NO3 MolecularWeight: 289.36942

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23NO3/c1-4-20-10-9-17(19)16(11-18)14-5-7-15(8-6-14)21-12-13(2)3/h5-8,13,16H,4,9-10,12H2,1-3H3