3-[(E)-3-(4-bromanylthiophen-2-yl)prop-2-enoyl]-6-methyl-2-oxidanyl-pyran-4-one

Systemtic Name: 3-[(E)-3-(4-bromanylthiophen-2-yl)prop-2-enoyl]-6-methyl-2-oxidanyl-pyran-4-one Openeye Name: 3-[(E)-3-(4-bromo-2-thienyl)prop-2-enoyl]-2-hydroxy-6-methyl-pyran-4-one CAS Name: 3-[(E)-3-(4-bromo-2-thiophenyl)-1-oxoprop-2-enyl]-2-hydroxy-6-methyl-4-pyranone IUPAC Name: 3-[(E)-3-(4-bromothiophen-2-yl)prop-2-enoyl]-2-hydroxy-6-methylpyran-4-one Traditional Name: 3-[(E)-3-(4-bromo-2-thienyl)acryloyl]-2-hydroxy-6-methyl-pyran-4-one Formula: C13H9BrO4S MolecularWeight: 341.17716

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(O1)O)C(=O)C=CC2=CC(=CS2)Br

Isomeric SMILES

CC1=CC(=O)C(=C(O1)O)C(=O)/C=C/C2=CC(=CS2)Br

InChI

InChI=1S/C13H9BrO4S/c1-7-4-11(16)12(13(17)18-7)10(15)3-2-9-5-8(14)6-19-9/h2-6,17H,1H3/b3-2+