5-bromanyl-4-oxidanylidene-pentanamide; propanedioic acid

Systemtic Name: 5-bromanyl-4-oxidanylidene-pentanamide; propanedioic acid Openeye Name: 5-bromo-4-oxo-pentanamide; malonic acid CAS Name: 5-bromo-4-oxopentanamide; propanedioic acid IUPAC Name: 5-bromo-4-oxopentanamide; propanedioic acid Traditional Name: 5-bromo-4-keto-valeramide; malonic acid Formula: C8H12BrNO6 MolecularWeight: 298.08798

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Descriptors Computed from Structure

Canonical SMILES:

C(CC(=O)N)C(=O)CBr.C(C(=O)O)C(=O)O

Isomeric SMILES

C(CC(=O)N)C(=O)CBr.C(C(=O)O)C(=O)O

InChI

InChI=1S/C5H8BrNO2.C3H4O4/c6-3-4(8)1-2-5(7)9;4-2(5)1-3(6)7/h1-3H2,(H2,7,9);1H2,(H,4,5)(H,6,7)