2-(4-methoxyphenyl)ethanenitrile; 5-oxabicyclo[2.1.1]hexane

Systemtic Name: 2-(4-methoxyphenyl)ethanenitrile; 5-oxabicyclo[2.1.1]hexane Openeye Name: 2-(4-methoxyphenyl)acetonitrile; 5-oxabicyclo[2.1.1]hexane CAS Name: 2-(4-methoxyphenyl)acetonitrile; 5-oxabicyclo[2.1.1]hexane IUPAC Name: 2-(4-methoxyphenyl)acetonitrile; 5-oxabicyclo[2.1.1]hexane Traditional Name: 2-(4-methoxyphenyl)acetonitrile; 5-oxabicyclo[2.1.1]hexane Formula: C14H17NO2 MolecularWeight: 231.29028

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC#N.C1CC2CC1O2

Isomeric SMILES

COC1=CC=C(C=C1)CC#N.C1CC2CC1O2

InChI

InChI=1S/C9H9NO.C5H8O/c1-11-9-4-2-8(3-5-9)6-7-10;1-2-5-3-4(1)6-5/h2-5H,6H2,1H3;4-5H,1-3H2