3-(1,3-benzodioxol-5-yl)-6-bromanyl-chromen-2-one

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-6-bromanyl-chromen-2-one Openeye Name: 3-(1,3-benzodioxol-5-yl)-6-bromo-chromen-2-one CAS Name: 3-(1,3-benzodioxol-5-yl)-6-bromo-1-benzopyran-2-one IUPAC Name: 3-(1,3-benzodioxol-5-yl)-6-bromochromen-2-one Traditional Name: 3-(1,3-benzodioxol-5-yl)-6-bromo-coumarin Formula: C16H9BrO4 MolecularWeight: 345.14426

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C3=CC4=C(C=CC(=C4)Br)OC3=O

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C3=CC4=C(C=CC(=C4)Br)OC3=O

InChI

InChI=1S/C16H9BrO4/c17-11-2-4-13-10(5-11)6-12(16(18)21-13)9-1-3-14-15(7-9)20-8-19-14/h1-7H,8H2