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

Systemtic Name: 3-heptylbicyclo[2.2.0]hexa-1(4),2,5-triene; 2-propyl-1,4-dioxane Openeye Name: 3-heptylbicyclo[2.2.0]hexa-1(4),2,5-triene; 2-propyl-1,4-dioxane CAS Name: 3-heptylbicyclo[2.2.0]hexa-1(4),2,5-triene; 2-propyl-1,4-dioxane IUPAC Name: 3-heptylbicyclo[2.2.0]hexa-1(4),2,5-triene; 2-propyl-1,4-dioxane Traditional Name: 3-heptylbicyclo[2.2.0]hexa-1(4),2,5-triene; 2-propyl-1,4-dioxane Formula: C20H32O2 MolecularWeight: 304.46688

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC2=C1C=C2.CCCC1COCCO1

Isomeric SMILES

CCCCCCCC1=CC2=C1C=C2.CCCC1COCCO1

InChI

InChI=1S/C13H18.C7H14O2/c1-2-3-4-5-6-7-11-10-12-8-9-13(11)12;1-2-3-7-6-8-4-5-9-7/h8-10H,2-7H2,1H3;7H,2-6H2,1H3