6-[(4-bromanyl-2,5-dimethoxy-phenyl)methylsulfanyl]-2,3-dihydro-1,4-benzodioxine

Systemtic Name: 6-[(4-bromanyl-2,5-dimethoxy-phenyl)methylsulfanyl]-2,3-dihydro-1,4-benzodioxine Openeye Name: 6-[(4-bromo-2,5-dimethoxy-phenyl)methylsulfanyl]-2,3-dihydro-1,4-benzodioxine CAS Name: 6-[(4-bromo-2,5-dimethoxyphenyl)methylthio]-2,3-dihydro-1,4-benzodioxin IUPAC Name: 6-[(4-bromo-2,5-dimethoxyphenyl)methylsulfanyl]-2,3-dihydro-1,4-benzodioxine Traditional Name: 6-[(4-bromo-2,5-dimethoxy-benzyl)thio]-2,3-dihydro-1,4-benzodioxin Formula: C17H17BrO4S MolecularWeight: 397.28348

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CSC2=CC3=C(C=C2)OCCO3)OC)Br

Isomeric SMILES

COC1=CC(=C(C=C1CSC2=CC3=C(C=C2)OCCO3)OC)Br

InChI

InChI=1S/C17H17BrO4S/c1-19-15-9-13(18)16(20-2)7-11(15)10-23-12-3-4-14-17(8-12)22-6-5-21-14/h3-4,7-9H,5-6,10H2,1-2H3