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

Systemtic Name: 3-hexoxybicyclo[2.2.0]hexa-1(4),2,5-triene; 2-pentyl-1,4-dioxane Openeye Name: 3-hexoxybicyclo[2.2.0]hexa-1(4),2,5-triene; 2-pentyl-1,4-dioxane CAS Name: 3-hexoxybicyclo[2.2.0]hexa-1(4),2,5-triene; 2-pentyl-1,4-dioxane IUPAC Name: 3-hexoxybicyclo[2.2.0]hexa-1(4),2,5-triene; 2-pentyl-1,4-dioxane Traditional Name: 2-amyl-1,4-dioxane; 3-hexoxybicyclo[2.2.0]hexa-1(4),2,5-triene Formula: C21H34O3 MolecularWeight: 334.49286

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC2=C1C=C2.CCCCCC1COCCO1

Isomeric SMILES

CCCCCCOC1=CC2=C1C=C2.CCCCCC1COCCO1

InChI

InChI=1S/C12H16O.C9H18O2/c1-2-3-4-5-8-13-12-9-10-6-7-11(10)12;1-2-3-4-5-9-8-10-6-7-11-9/h6-7,9H,2-5,8H2,1H3;9H,2-8H2,1H3