2-(3-methoxy-4-methyl-phenyl)-5,5-dimethyl-3-oxidanylidene-hexanenitrile

Systemtic Name: 2-(3-methoxy-4-methyl-phenyl)-5,5-dimethyl-3-oxidanylidene-hexanenitrile Openeye Name: 2-(3-methoxy-4-methyl-phenyl)-5,5-dimethyl-3-oxo-hexanenitrile CAS Name: 2-(3-methoxy-4-methylphenyl)-5,5-dimethyl-3-oxohexanenitrile IUPAC Name: 2-(3-methoxy-4-methylphenyl)-5,5-dimethyl-3-oxohexanenitrile Traditional Name: 3-keto-2-(3-methoxy-4-methyl-phenyl)-5,5-dimethyl-hexanenitrile Formula: C16H21NO2 MolecularWeight: 259.34344

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C#N)C(=O)CC(C)(C)C)OC

Isomeric SMILES

CC1=C(C=C(C=C1)C(C#N)C(=O)CC(C)(C)C)OC

InChI

InChI=1S/C16H21NO2/c1-11-6-7-12(8-15(11)19-5)13(10-17)14(18)9-16(2,3)4/h6-8,13H,9H2,1-5H3