(1-oxidanylcyclohexyl)methyl (1S,5R)-3-bromanylbicyclo[3.3.1]nonane-7-carboxylate

Systemtic Name: (1-oxidanylcyclohexyl)methyl (1S,5R)-3-bromanylbicyclo[3.3.1]nonane-7-carboxylate Openeye Name: (1-hydroxycyclohexyl)methyl (1S,5R)-3-bromobicyclo[3.3.1]nonane-7-carboxylate CAS Name: (1S,5R)-3-bromo-7-bicyclo[3.3.1]nonanecarboxylic acid (1-hydroxycyclohexyl)methyl ester IUPAC Name: (1-hydroxycyclohexyl)methyl (1S,5R)-3-bromobicyclo[3.3.1]nonane-7-carboxylate Traditional Name: (1S,5R)-3-bromobicyclo[3.3.1]nonane-7-carboxylic acid (1-hydroxycyclohexyl)methyl ester Formula: C17H27BrO3 MolecularWeight: 359.29848

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(COC(=O)C2CC3CC(C2)CC(C3)Br)O

Isomeric SMILES

C1CCC(CC1)(COC(=O)C2C[C@H]3C[C@@H](C2)CC(C3)Br)O

InChI

InChI=1S/C17H27BrO3/c18-15-9-12-6-13(10-15)8-14(7-12)16(19)21-11-17(20)4-2-1-3-5-17/h12-15,20H,1-11H2/t12-,13+,14?,15?