5-bromanyl-2-oxidanyl-3-(1-phenylpropyl)-6-propyl-pyran-4-one

Systemtic Name: 5-bromanyl-2-oxidanyl-3-(1-phenylpropyl)-6-propyl-pyran-4-one Openeye Name: 5-bromo-2-hydroxy-3-(1-phenylpropyl)-6-propyl-pyran-4-one CAS Name: 5-bromo-2-hydroxy-3-(1-phenylpropyl)-6-propyl-4-pyranone IUPAC Name: 5-bromo-2-hydroxy-3-(1-phenylpropyl)-6-propylpyran-4-one Traditional Name: 5-bromo-2-hydroxy-3-(1-phenylpropyl)-6-propyl-pyran-4-one Formula: C17H19BrO3 MolecularWeight: 351.23496

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=O)C(=C(O1)O)C(CC)C2=CC=CC=C2)Br

Isomeric SMILES

CCCC1=C(C(=O)C(=C(O1)O)C(CC)C2=CC=CC=C2)Br

InChI

InChI=1S/C17H19BrO3/c1-3-8-13-15(18)16(19)14(17(20)21-13)12(4-2)11-9-6-5-7-10-11/h5-7,9-10,12,20H,3-4,8H2,1-2H3