5-bromanyl-3-butyl-2-oxidanyl-6-propyl-pyran-4-one

Systemtic Name: 5-bromanyl-3-butyl-2-oxidanyl-6-propyl-pyran-4-one Openeye Name: 5-bromo-3-butyl-2-hydroxy-6-propyl-pyran-4-one CAS Name: 5-bromo-3-butyl-2-hydroxy-6-propyl-4-pyranone IUPAC Name: 5-bromo-3-butyl-2-hydroxy-6-propylpyran-4-one Traditional Name: 5-bromo-3-butyl-2-hydroxy-6-propyl-pyran-4-one Formula: C12H17BrO3 MolecularWeight: 289.16558

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(OC(=C(C1=O)Br)CCC)O

Isomeric SMILES

CCCCC1=C(OC(=C(C1=O)Br)CCC)O

InChI

InChI=1S/C12H17BrO3/c1-3-5-7-8-11(14)10(13)9(6-4-2)16-12(8)15/h15H,3-7H2,1-2H3