2-(3-bromanyl-4-oxidanylidene-cyclohexyl)propanoic acid

Systemtic Name: 2-(3-bromanyl-4-oxidanylidene-cyclohexyl)propanoic acid Openeye Name: 2-(3-bromo-4-oxo-cyclohexyl)propanoic acid CAS Name: 2-(3-bromo-4-oxocyclohexyl)propanoic acid IUPAC Name: 2-(3-bromo-4-oxocyclohexyl)propanoic acid Traditional Name: 2-(3-bromo-4-keto-cyclohexyl)propionic acid Formula: C9H13BrO3 MolecularWeight: 249.10172

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CCC(=O)C(C1)Br)C(=O)O

Isomeric SMILES

CC(C1CCC(=O)C(C1)Br)C(=O)O

InChI

InChI=1S/C9H13BrO3/c1-5(9(12)13)6-2-3-8(11)7(10)4-6/h5-7H,2-4H2,1H3,(H,12,13)