7-bromanyl-4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)chromen-2-one

Systemtic Name: 7-bromanyl-4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)chromen-2-one Openeye Name: 7-bromo-4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)chromen-2-one CAS Name: 7-bromo-4-[(2,3-dihydro-1,4-benzodioxin-6-ylthio)methyl]-1-benzopyran-2-one IUPAC Name: 7-bromo-4-(2,3-dihydro-1,4-benzodioxin-6-ylsulfanylmethyl)chromen-2-one Traditional Name: 7-bromo-4-[(2,3-dihydro-1,4-benzodioxin-6-ylthio)methyl]coumarin Formula: C18H13BrO4S MolecularWeight: 405.26242

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)SCC3=CC(=O)OC4=C3C=CC(=C4)Br

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)SCC3=CC(=O)OC4=C3C=CC(=C4)Br

InChI

InChI=1S/C18H13BrO4S/c19-12-1-3-14-11(7-18(20)23-16(14)8-12)10-24-13-2-4-15-17(9-13)22-6-5-21-15/h1-4,7-9H,5-6,10H2