2-[2-(1,3-benzodioxol-5-yl)ethyl]-5-bromanyl-6-oxidanyl-2-phenyl-3H-pyran-4-one

Systemtic Name: 2-[2-(1,3-benzodioxol-5-yl)ethyl]-5-bromanyl-6-oxidanyl-2-phenyl-3H-pyran-4-one Openeye Name: 2-[2-(1,3-benzodioxol-5-yl)ethyl]-5-bromo-6-hydroxy-2-phenyl-3H-pyran-4-one CAS Name: 2-[2-(1,3-benzodioxol-5-yl)ethyl]-5-bromo-6-hydroxy-2-phenyl-3H-pyran-4-one IUPAC Name: 2-[2-(1,3-benzodioxol-5-yl)ethyl]-5-bromo-6-hydroxy-2-phenyl-3H-pyran-4-one Traditional Name: 5-bromo-2-homopiperonyl-6-hydroxy-2-phenyl-3H-pyran-4-one Formula: C20H17BrO5 MolecularWeight: 417.24998

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)C(=C(OC1(CCC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4)O)Br

Isomeric SMILES

C1C(=O)C(=C(OC1(CCC2=CC3=C(C=C2)OCO3)C4=CC=CC=C4)O)Br

InChI

InChI=1S/C20H17BrO5/c21-18-15(22)11-20(26-19(18)23,14-4-2-1-3-5-14)9-8-13-6-7-16-17(10-13)25-12-24-16/h1-7,10,23H,8-9,11-12H2