2-(3-methoxy-4-methyl-phenyl)-3-oxidanylidene-heptanenitrile

Systemtic Name: 2-(3-methoxy-4-methyl-phenyl)-3-oxidanylidene-heptanenitrile Openeye Name: 2-(3-methoxy-4-methyl-phenyl)-3-oxo-heptanenitrile CAS Name: 2-(3-methoxy-4-methylphenyl)-3-oxoheptanenitrile IUPAC Name: 2-(3-methoxy-4-methylphenyl)-3-oxoheptanenitrile Traditional Name: 3-keto-2-(3-methoxy-4-methyl-phenyl)enanthonitrile Formula: C15H19NO2 MolecularWeight: 245.31686

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H19NO2/c1-4-5-6-14(17)13(10-16)12-8-7-11(2)15(9-12)18-3/h7-9,13H,4-6H2,1-3H3