3-(4-butoxyphenyl)-3-oxidanylidene-propanenitrile

Systemtic Name: 3-(4-butoxyphenyl)-3-oxidanylidene-propanenitrile Openeye Name: 3-(4-butoxyphenyl)-3-oxo-propanenitrile CAS Name: 3-(4-butoxyphenyl)-3-oxopropanenitrile IUPAC Name: 3-(4-butoxyphenyl)-3-oxopropanenitrile Traditional Name: 3-(4-butoxyphenyl)-3-keto-propionitrile Formula: C13H15NO2 MolecularWeight: 217.2637

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)CC#N

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)CC#N

InChI

InChI=1S/C13H15NO2/c1-2-3-10-16-12-6-4-11(5-7-12)13(15)8-9-14/h4-7H,2-3,8,10H2,1H3