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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO2/c1-5-12(6-2)16(18)14(10-17)13-9-11(3)7-8-15(13)19-4/h7-9,12,14H,5-6H2,1-4H3