3-[(E)-3-(6-bromanyl-1,3-benzodioxol-5-yl)prop-2-enoyl]-6-methyl-2-oxidanyl-pyran-4-one

Systemtic Name: 3-[(E)-3-(6-bromanyl-1,3-benzodioxol-5-yl)prop-2-enoyl]-6-methyl-2-oxidanyl-pyran-4-one Openeye Name: 3-[(E)-3-(6-bromo-1,3-benzodioxol-5-yl)prop-2-enoyl]-2-hydroxy-6-methyl-pyran-4-one CAS Name: 3-[(E)-3-(6-bromo-1,3-benzodioxol-5-yl)-1-oxoprop-2-enyl]-2-hydroxy-6-methyl-4-pyranone IUPAC Name: 3-[(E)-3-(6-bromo-1,3-benzodioxol-5-yl)prop-2-enoyl]-2-hydroxy-6-methylpyran-4-one Traditional Name: 3-[(E)-3-(6-bromo-1,3-benzodioxol-5-yl)acryloyl]-2-hydroxy-6-methyl-pyran-4-one Formula: C16H11BrO6 MolecularWeight: 379.15894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(O1)O)C(=O)C=CC2=CC3=C(C=C2Br)OCO3

Isomeric SMILES

CC1=CC(=O)C(=C(O1)O)C(=O)/C=C/C2=CC3=C(C=C2Br)OCO3

InChI

InChI=1S/C16H11BrO6/c1-8-4-12(19)15(16(20)23-8)11(18)3-2-9-5-13-14(6-10(9)17)22-7-21-13/h2-6,20H,7H2,1H3/b3-2+