2-(3,4-dimethoxyphenyl)-3-oxidanylidene-octanenitrile

Systemtic Name: 2-(3,4-dimethoxyphenyl)-3-oxidanylidene-octanenitrile Openeye Name: 2-(3,4-dimethoxyphenyl)-3-oxo-octanenitrile CAS Name: 2-(3,4-dimethoxyphenyl)-3-oxooctanenitrile IUPAC Name: 2-(3,4-dimethoxyphenyl)-3-oxooctanenitrile Traditional Name: 2-(3,4-dimethoxyphenyl)-3-keto-caprylonitrile Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C(C#N)C1=CC(=C(C=C1)OC)OC

Isomeric SMILES

CCCCCC(=O)C(C#N)C1=CC(=C(C=C1)OC)OC

InChI

InChI=1S/C16H21NO3/c1-4-5-6-7-14(18)13(11-17)12-8-9-15(19-2)16(10-12)20-3/h8-10,13H,4-7H2,1-3H3