4-(4-methanoyl-2,6-dimethyl-phenoxy)butanenitrile

Systemtic Name: 4-(4-methanoyl-2,6-dimethyl-phenoxy)butanenitrile Openeye Name: 4-(4-formyl-2,6-dimethyl-phenoxy)butanenitrile CAS Name: 4-(4-formyl-2,6-dimethylphenoxy)butanenitrile IUPAC Name: 4-(4-formyl-2,6-dimethylphenoxy)butanenitrile Traditional Name: 4-(4-formyl-2,6-dimethyl-phenoxy)butyronitrile Formula: C13H15NO2 MolecularWeight: 217.2637

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCCCC#N)C)C=O

Isomeric SMILES

CC1=CC(=CC(=C1OCCCC#N)C)C=O

InChI

InChI=1S/C13H15NO2/c1-10-7-12(9-15)8-11(2)13(10)16-6-4-3-5-14/h7-9H,3-4,6H2,1-2H3