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

Systemtic Name: bicyclo[2.2.0]hexa-1(4),2,5-triene-3-carbonitrile; 5-butyl-1,3-dioxane Openeye Name: bicyclo[2.2.0]hexa-1(4),2,5-triene-3-carbonitrile; 5-butyl-1,3-dioxane CAS Name: 3-bicyclo[2.2.0]hexa-1(4),2,5-trienecarbonitrile; 5-butyl-1,3-dioxane IUPAC Name: bicyclo[2.2.0]hexa-1(4),2,5-triene-3-carbonitrile; 5-butyl-1,3-dioxane Traditional Name: bicyclo[2.2.0]hexa-1(4),2,5-triene-3-carbonitrile; 5-butyl-1,3-dioxane Formula: C15H19NO2 MolecularWeight: 245.31686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1COCOC1.C1=CC2=C1C=C2C#N

Isomeric SMILES

CCCCC1COCOC1.C1=CC2=C1C=C2C#N

InChI

InChI=1S/C8H16O2.C7H3N/c1-2-3-4-8-5-9-7-10-6-8;8-4-6-3-5-1-2-7(5)6/h8H,2-7H2,1H3;1-3H