2-(2-methoxyphenyl)-3-oxidanylidene-heptanenitrile

Systemtic Name: 2-(2-methoxyphenyl)-3-oxidanylidene-heptanenitrile Openeye Name: 2-(2-methoxyphenyl)-3-oxo-heptanenitrile CAS Name: 2-(2-methoxyphenyl)-3-oxoheptanenitrile IUPAC Name: 2-(2-methoxyphenyl)-3-oxoheptanenitrile Traditional Name: 3-keto-2-(2-methoxyphenyl)enanthonitrile Formula: C14H17NO2 MolecularWeight: 231.29028

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C(C#N)C1=CC=CC=C1OC

Isomeric SMILES

CCCCC(=O)C(C#N)C1=CC=CC=C1OC

InChI

InChI=1S/C14H17NO2/c1-3-4-8-13(16)12(10-15)11-7-5-6-9-14(11)17-2/h5-7,9,12H,3-4,8H2,1-2H3