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

Systemtic Name: 2-[2-(1,3-benzodioxol-5-yl)ethyl]-6-oxidanyl-2-phenyl-3H-pyran-4-one Openeye Name: 2-[2-(1,3-benzodioxol-5-yl)ethyl]-6-hydroxy-2-phenyl-3H-pyran-4-one CAS Name: 2-[2-(1,3-benzodioxol-5-yl)ethyl]-6-hydroxy-2-phenyl-3H-pyran-4-one IUPAC Name: 2-[2-(1,3-benzodioxol-5-yl)ethyl]-6-hydroxy-2-phenyl-3H-pyran-4-one Traditional Name: 2-homopiperonyl-6-hydroxy-2-phenyl-3H-pyran-4-one Formula: C20H18O5 MolecularWeight: 338.35392

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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

Isomeric SMILES

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

InChI

InChI=1S/C20H18O5/c21-16-11-19(22)25-20(12-16,15-4-2-1-3-5-15)9-8-14-6-7-17-18(10-14)24-13-23-17/h1-7,10-11,22H,8-9,12-13H2