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

Systemtic Name: 3-butylbicyclo[2.2.0]hexa-1(4),2,5-triene; 2-heptyl-1,4-dioxane Openeye Name: 3-butylbicyclo[2.2.0]hexa-1(4),2,5-triene; 2-heptyl-1,4-dioxane CAS Name: 3-butylbicyclo[2.2.0]hexa-1(4),2,5-triene; 2-heptyl-1,4-dioxane IUPAC Name: 3-butylbicyclo[2.2.0]hexa-1(4),2,5-triene; 2-heptyl-1,4-dioxane Traditional Name: 3-butylbicyclo[2.2.0]hexa-1(4),2,5-triene; 2-heptyl-1,4-dioxane Formula: C21H34O2 MolecularWeight: 318.49346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1COCCO1.CCCCC1=CC2=C1C=C2

Isomeric SMILES

CCCCCCCC1COCCO1.CCCCC1=CC2=C1C=C2

InChI

InChI=1S/C11H22O2.C10H12/c1-2-3-4-5-6-7-11-10-12-8-9-13-11;1-2-3-4-8-7-9-5-6-10(8)9/h11H,2-10H2,1H3;5-7H,2-4H2,1H3