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

Systemtic Name: 3-[(E)-3-[4,5-bis(bromanyl)thiophen-2-yl]prop-2-enoyl]-6-methyl-2-oxidanyl-pyran-4-one Openeye Name: 3-[(E)-3-(4,5-dibromo-2-thienyl)prop-2-enoyl]-2-hydroxy-6-methyl-pyran-4-one CAS Name: 3-[(E)-3-(4,5-dibromo-2-thiophenyl)-1-oxoprop-2-enyl]-2-hydroxy-6-methyl-4-pyranone IUPAC Name: 3-[(E)-3-(4,5-dibromothiophen-2-yl)prop-2-enoyl]-2-hydroxy-6-methylpyran-4-one Traditional Name: 3-[(E)-3-(4,5-dibromo-2-thienyl)acryloyl]-2-hydroxy-6-methyl-pyran-4-one Formula: C13H8Br2O4S MolecularWeight: 420.07322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(=C(O1)O)C(=O)C=CC2=CC(=C(S2)Br)Br

Isomeric SMILES

CC1=CC(=O)C(=C(O1)O)C(=O)/C=C/C2=CC(=C(S2)Br)Br

InChI

InChI=1S/C13H8Br2O4S/c1-6-4-10(17)11(13(18)19-6)9(16)3-2-7-5-8(14)12(15)20-7/h2-5,18H,1H3/b3-2+