2-(bromomethyl)-2,3-dimethyl-4-oxidanylidene-cyclohexane-1-carboxylic acid

Systemtic Name: 2-(bromomethyl)-2,3-dimethyl-4-oxidanylidene-cyclohexane-1-carboxylic acid Openeye Name: 2-(bromomethyl)-2,3-dimethyl-4-oxo-cyclohexanecarboxylic acid CAS Name: 2-(bromomethyl)-2,3-dimethyl-4-oxo-1-cyclohexanecarboxylic acid IUPAC Name: 2-(bromomethyl)-2,3-dimethyl-4-oxocyclohexane-1-carboxylic acid Traditional Name: 2-(bromomethyl)-4-keto-2,3-dimethyl-cyclohexanecarboxylic acid Formula: C10H15BrO3 MolecularWeight: 263.1283

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)CCC(C1(C)CBr)C(=O)O

Isomeric SMILES

CC1C(=O)CCC(C1(C)CBr)C(=O)O

InChI

InChI=1S/C10H15BrO3/c1-6-8(12)4-3-7(9(13)14)10(6,2)5-11/h6-7H,3-5H2,1-2H3,(H,13,14)