N-(5-bromanyl-2-oxidanyl-phenyl)-4,4-dimethyl-3-oxidanylidene-pentanamide

Systemtic Name: N-(5-bromanyl-2-oxidanyl-phenyl)-4,4-dimethyl-3-oxidanylidene-pentanamide Openeye Name: N-(5-bromo-2-hydroxy-phenyl)-4,4-dimethyl-3-oxo-pentanamide CAS Name: N-(5-bromo-2-hydroxyphenyl)-4,4-dimethyl-3-oxopentanamide IUPAC Name: N-(5-bromo-2-hydroxyphenyl)-4,4-dimethyl-3-oxopentanamide Traditional Name: N-(5-bromo-2-hydroxy-phenyl)-3-keto-4,4-dimethyl-valeramide Formula: C13H16BrNO3 MolecularWeight: 314.17504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CC(=O)NC1=C(C=CC(=C1)Br)O

Isomeric SMILES

CC(C)(C)C(=O)CC(=O)NC1=C(C=CC(=C1)Br)O

InChI

InChI=1S/C13H16BrNO3/c1-13(2,3)11(17)7-12(18)15-9-6-8(14)4-5-10(9)16/h4-6,16H,7H2,1-3H3,(H,15,18)