6-(3-methoxyphenyl)-6-oxidanylidene-hexanenitrile

Systemtic Name: 6-(3-methoxyphenyl)-6-oxidanylidene-hexanenitrile Openeye Name: 6-(3-methoxyphenyl)-6-oxo-hexanenitrile CAS Name: 6-(3-methoxyphenyl)-6-oxohexanenitrile IUPAC Name: 6-(3-methoxyphenyl)-6-oxohexanenitrile Traditional Name: 6-keto-6-(3-methoxyphenyl)hexanenitrile Formula: C13H15NO2 MolecularWeight: 217.2637

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)CCCCC#N

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)CCCCC#N

InChI

InChI=1S/C13H15NO2/c1-16-12-7-5-6-11(10-12)13(15)8-3-2-4-9-14/h5-7,10H,2-4,8H2,1H3