4-bromanyl-4-(4,4-dimethyl-5H-1,3-oxazol-2-yl)butanal

Systemtic Name: 4-bromanyl-4-(4,4-dimethyl-5H-1,3-oxazol-2-yl)butanal Openeye Name: 4-bromo-4-(4,4-dimethyl-5H-oxazol-2-yl)butanal CAS Name: 4-bromo-4-(4,4-dimethyl-5H-oxazol-2-yl)butanal IUPAC Name: 4-bromo-4-(4,4-dimethyl-5H-1,3-oxazol-2-yl)butanal Traditional Name: 4-bromo-4-(4,4-dimethyl-2-oxazolin-2-yl)butyraldehyde Formula: C9H14BrNO2 MolecularWeight: 248.11696

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(=N1)C(CCC=O)Br)C

Isomeric SMILES

CC1(COC(=N1)C(CCC=O)Br)C

InChI

InChI=1S/C9H14BrNO2/c1-9(2)6-13-8(11-9)7(10)4-3-5-12/h5,7H,3-4,6H2,1-2H3