2-hexoxy-8-thiabicyclo[2.2.2]octa-1,3,5-triene

Systemtic Name: 2-hexoxy-8-thiabicyclo[2.2.2]octa-1,3,5-triene Openeye Name: 2-hexoxy-8-thiabicyclo[2.2.2]octa-1,3,5-triene CAS Name: 2-hexoxy-8-thiabicyclo[2.2.2]octa-1,3,5-triene IUPAC Name: 2-hexoxy-8-thiabicyclo[2.2.2]octa-1,3,5-triene Traditional Name: 2-hexoxy-8-thiabicyclo[2.2.2]octa-1,3,5-triene Formula: C13H18OS MolecularWeight: 222.34642

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=C2CSC(=C1)C=C2

Isomeric SMILES

CCCCCCOC1=C2CSC(=C1)C=C2

InChI

InChI=1S/C13H18OS/c1-2-3-4-5-8-14-13-9-12-7-6-11(13)10-15-12/h6-7,9H,2-5,8,10H2,1H3