2-(3,4-dimethoxyphenyl)-5,5-dimethyl-3-oxidanylidene-hexanenitrile

Systemtic Name: 2-(3,4-dimethoxyphenyl)-5,5-dimethyl-3-oxidanylidene-hexanenitrile Openeye Name: 2-(3,4-dimethoxyphenyl)-5,5-dimethyl-3-oxo-hexanenitrile CAS Name: 2-(3,4-dimethoxyphenyl)-5,5-dimethyl-3-oxohexanenitrile IUPAC Name: 2-(3,4-dimethoxyphenyl)-5,5-dimethyl-3-oxohexanenitrile Traditional Name: 2-(3,4-dimethoxyphenyl)-3-keto-5,5-dimethyl-hexanenitrile Formula: C16H21NO3 MolecularWeight: 275.34284

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO3/c1-16(2,3)9-13(18)12(10-17)11-6-7-14(19-4)15(8-11)20-5/h6-8,12H,9H2,1-5H3