1-[(1S)-1-bromanyl-2-oxidanyl-2-oxidanylidene-ethyl]-4-methyl-cyclohexane-1-carboxylic acid

Systemtic Name: 1-[(1S)-1-bromanyl-2-oxidanyl-2-oxidanylidene-ethyl]-4-methyl-cyclohexane-1-carboxylic acid Openeye Name: 1-[(1S)-1-bromo-2-hydroxy-2-oxo-ethyl]-4-methyl-cyclohexanecarboxylic acid CAS Name: 1-[(1S)-1-bromo-2-hydroxy-2-oxoethyl]-4-methyl-1-cyclohexanecarboxylic acid IUPAC Name: 1-[(1S)-1-bromo-2-hydroxy-2-oxoethyl]-4-methylcyclohexane-1-carboxylic acid Traditional Name: 1-[(1S)-1-bromo-2-hydroxy-2-keto-ethyl]-4-methyl-cyclohexanecarboxylic acid Formula: C10H15BrO4 MolecularWeight: 279.1277

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)(C(C(=O)O)Br)C(=O)O

Isomeric SMILES

CC1CCC(CC1)([C@@H](C(=O)O)Br)C(=O)O

InChI

InChI=1S/C10H15BrO4/c1-6-2-4-10(5-3-6,9(14)15)7(11)8(12)13/h6-7H,2-5H2,1H3,(H,12,13)(H,14,15)/t6?,7-,10?/m1/s1