5-(4-bromanyl-2-chloranyl-6-ethyl-phenyl)-2,2-dimethyl-6-oxidanyl-3H-pyran-4-one

Systemtic Name: 5-(4-bromanyl-2-chloranyl-6-ethyl-phenyl)-2,2-dimethyl-6-oxidanyl-3H-pyran-4-one Openeye Name: 5-(4-bromo-2-chloro-6-ethyl-phenyl)-6-hydroxy-2,2-dimethyl-3H-pyran-4-one CAS Name: 5-(4-bromo-2-chloro-6-ethylphenyl)-6-hydroxy-2,2-dimethyl-3H-pyran-4-one IUPAC Name: 5-(4-bromo-2-chloro-6-ethylphenyl)-6-hydroxy-2,2-dimethyl-3H-pyran-4-one Traditional Name: 5-(4-bromo-2-chloro-6-ethyl-phenyl)-6-hydroxy-2,2-dimethyl-3H-pyran-4-one Formula: C15H16BrClO3 MolecularWeight: 359.64274

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=C1C2=C(OC(CC2=O)(C)C)O)Cl)Br

Isomeric SMILES

CCC1=CC(=CC(=C1C2=C(OC(CC2=O)(C)C)O)Cl)Br

InChI

InChI=1S/C15H16BrClO3/c1-4-8-5-9(16)6-10(17)12(8)13-11(18)7-15(2,3)20-14(13)19/h5-6,19H,4,7H2,1-3H3