3,6,8-tris(bromanyl)-4-(hydroxymethyl)-7-oxidanyl-chromen-2-one

Systemtic Name: 3,6,8-tris(bromanyl)-4-(hydroxymethyl)-7-oxidanyl-chromen-2-one Openeye Name: 3,6,8-tribromo-7-hydroxy-4-(hydroxymethyl)chromen-2-one CAS Name: 3,6,8-tribromo-7-hydroxy-4-(hydroxymethyl)-1-benzopyran-2-one IUPAC Name: 3,6,8-tribromo-7-hydroxy-4-(hydroxymethyl)chromen-2-one Traditional Name: 3,6,8-tribromo-7-hydroxy-4-methylol-coumarin Formula: C10H5Br3O4 MolecularWeight: 428.8563

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Descriptors Computed from Structure

Canonical SMILES:

C1=C2C(=C(C(=O)OC2=C(C(=C1Br)O)Br)Br)CO

Isomeric SMILES

C1=C2C(=C(C(=O)OC2=C(C(=C1Br)O)Br)Br)CO

InChI

InChI=1S/C10H5Br3O4/c11-5-1-3-4(2-14)6(12)10(16)17-9(3)7(13)8(5)15/h1,14-15H,2H2