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

Systemtic Name: 3-heptylbicyclo[2.2.0]hexa-1(4),2,5-triene; 2-hexyl-1,4-dioxane Openeye Name: 3-heptylbicyclo[2.2.0]hexa-1(4),2,5-triene; 2-hexyl-1,4-dioxane CAS Name: 3-heptylbicyclo[2.2.0]hexa-1(4),2,5-triene; 2-hexyl-1,4-dioxane IUPAC Name: 3-heptylbicyclo[2.2.0]hexa-1(4),2,5-triene; 2-hexyl-1,4-dioxane Traditional Name: 3-heptylbicyclo[2.2.0]hexa-1(4),2,5-triene; 2-hexyl-1,4-dioxane Formula: C23H38O2 MolecularWeight: 346.54662

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC2=C1C=C2.CCCCCCC1COCCO1

Isomeric SMILES

CCCCCCCC1=CC2=C1C=C2.CCCCCCC1COCCO1

InChI

InChI=1S/C13H18.C10H20O2/c1-2-3-4-5-6-7-11-10-12-8-9-13(11)12;1-2-3-4-5-6-10-9-11-7-8-12-10/h8-10H,2-7H2,1H3;10H,2-9H2,1H3