5-(3-octylsulfanylpropyl)-1,3-benzodioxole

Systemtic Name: 5-(3-octylsulfanylpropyl)-1,3-benzodioxole Openeye Name: 5-(3-octylsulfanylpropyl)-1,3-benzodioxole CAS Name: 5-[3-(octylthio)propyl]-1,3-benzodioxole IUPAC Name: 5-(3-octylsulfanylpropyl)-1,3-benzodioxole Traditional Name: 5-[3-(octylthio)propyl]-1,3-benzodioxole Formula: C18H28O2S MolecularWeight: 308.47872

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSCCCC1=CC2=C(C=C1)OCO2

Isomeric SMILES

CCCCCCCCSCCCC1=CC2=C(C=C1)OCO2

InChI

InChI=1S/C18H28O2S/c1-2-3-4-5-6-7-12-21-13-8-9-16-10-11-17-18(14-16)20-15-19-17/h10-11,14H,2-9,12-13,15H2,1H3