bicyclo[2.2.0]hexa-1(4),2,5-triene-3-carbonitrile; 4-propyl-1,2-dioxane

Systemtic Name: bicyclo[2.2.0]hexa-1(4),2,5-triene-3-carbonitrile; 4-propyl-1,2-dioxane Openeye Name: bicyclo[2.2.0]hexa-1(4),2,5-triene-3-carbonitrile; 4-propyldioxane CAS Name: 3-bicyclo[2.2.0]hexa-1(4),2,5-trienecarbonitrile; 4-propyldioxane IUPAC Name: bicyclo[2.2.0]hexa-1(4),2,5-triene-3-carbonitrile; 4-propyldioxane Traditional Name: bicyclo[2.2.0]hexa-1(4),2,5-triene-3-carbonitrile; 4-propyldioxane Formula: C14H17NO2 MolecularWeight: 231.29028

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCOOC1.C1=CC2=C1C=C2C#N

Isomeric SMILES

CCCC1CCOOC1.C1=CC2=C1C=C2C#N

InChI

InChI=1S/C7H3N.C7H14O2/c8-4-6-3-5-1-2-7(5)6;1-2-3-7-4-5-8-9-6-7/h1-3H;7H,2-6H2,1H3