4-[2-(4-methylpentoxy)ethanoyl]benzenecarbonitrile

Systemtic Name: 4-[2-(4-methylpentoxy)ethanoyl]benzenecarbonitrile Openeye Name: 4-(2-isohexyloxyacetyl)benzonitrile CAS Name: 4-[2-(4-methylpentoxy)-1-oxoethyl]benzonitrile IUPAC Name: 4-[2-(4-methylpentoxy)acetyl]benzonitrile Traditional Name: 4-(2-isohexyloxyacetyl)benzonitrile Formula: C15H19NO2 MolecularWeight: 245.31686

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCOCC(=O)C1=CC=C(C=C1)C#N

Isomeric SMILES

CC(C)CCCOCC(=O)C1=CC=C(C=C1)C#N

InChI

InChI=1S/C15H19NO2/c1-12(2)4-3-9-18-11-15(17)14-7-5-13(10-16)6-8-14/h5-8,12H,3-4,9,11H2,1-2H3