[(2R)-octan-2-yl] 4-bromanylbenzoate

Systemtic Name: [(2R)-octan-2-yl] 4-bromanylbenzoate Openeye Name: [(1R)-1-methylheptyl] 4-bromobenzoate CAS Name: 4-bromobenzoic acid [(2R)-octan-2-yl] ester IUPAC Name: [(2R)-octan-2-yl] 4-bromobenzoate Traditional Name: 4-bromobenzoic acid [(1R)-1-methylheptyl] ester Formula: C15H21BrO2 MolecularWeight: 313.23004

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC(=O)C1=CC=C(C=C1)Br

Isomeric SMILES

CCCCCC[C@@H](C)OC(=O)C1=CC=C(C=C1)Br

InChI

InChI=1S/C15H21BrO2/c1-3-4-5-6-7-12(2)18-15(17)13-8-10-14(16)11-9-13/h8-12H,3-7H2,1-2H3/t12-/m1/s1