methyl (1R,2R)-2-(2-bromophenyl)-5-oxidanylidene-cyclohexane-1-carboxylate

Systemtic Name: methyl (1R,2R)-2-(2-bromophenyl)-5-oxidanylidene-cyclohexane-1-carboxylate Openeye Name: methyl (1R,2R)-2-(2-bromophenyl)-5-oxo-cyclohexanecarboxylate CAS Name: (1R,2R)-2-(2-bromophenyl)-5-oxo-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl (1R,2R)-2-(2-bromophenyl)-5-oxocyclohexane-1-carboxylate Traditional Name: (1R,2R)-2-(2-bromophenyl)-5-keto-cyclohexanecarboxylic acid methyl ester Formula: C14H15BrO3 MolecularWeight: 311.1711

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC(=O)CCC1C2=CC=CC=C2Br

Isomeric SMILES

COC(=O)[C@@H]1CC(=O)CC[C@H]1C2=CC=CC=C2Br

InChI

InChI=1S/C14H15BrO3/c1-18-14(17)12-8-9(16)6-7-10(12)11-4-2-3-5-13(11)15/h2-5,10,12H,6-8H2,1H3/t10-,12+/m0/s1