(2S)-6-bromanyl-8-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-2-phenyl-4H-1,3-benzodioxine

Systemtic Name: (2S)-6-bromanyl-8-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-2-phenyl-4H-1,3-benzodioxine Openeye Name: (2S)-6-bromo-8-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-2-phenyl-4H-1,3-benzodioxine CAS Name: (2S)-6-bromo-8-[(2,3-dihydro-1,4-benzodioxin-6-ylthio)methyl]-2-phenyl-4H-1,3-benzodioxin IUPAC Name: (2S)-6-bromo-8-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)-2-phenyl-4H-1,3-benzodioxine Traditional Name: (2S)-6-bromo-8-[(2,3-dihydro-1,4-benzodioxin-6-ylthio)methyl]-2-phenyl-4H-1,3-benzodioxin Formula: C23H19BrO4S MolecularWeight: 471.36356

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)SCC3=C4C(=CC(=C3)Br)COC(O4)C5=CC=CC=C5

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)SCC3=C4C(=CC(=C3)Br)CO[C@@H](O4)C5=CC=CC=C5

InChI

InChI=1S/C23H19BrO4S/c24-18-10-16-13-27-23(15-4-2-1-3-5-15)28-22(16)17(11-18)14-29-19-6-7-20-21(12-19)26-9-8-25-20/h1-7,10-12,23H,8-9,13-14H2/t23-/m0/s1