(3,4-dimethyl-1-adamantyl) 4-bromanylbutanoate

Systemtic Name: (3,4-dimethyl-1-adamantyl) 4-bromanylbutanoate Openeye Name: (3,4-dimethyl-1-adamantyl) 4-bromobutanoate CAS Name: 4-bromobutanoic acid (3,4-dimethyl-1-adamantyl) ester IUPAC Name: (3,4-dimethyl-1-adamantyl) 4-bromobutanoate Traditional Name: 4-bromobutyric acid (3,4-dimethyl-1-adamantyl) ester Formula: C16H25BrO2 MolecularWeight: 329.2725

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2CC3CC1(CC(C3)(C2)OC(=O)CCCBr)C

Isomeric SMILES

CC1C2CC3CC1(CC(C3)(C2)OC(=O)CCCBr)C

InChI

InChI=1S/C16H25BrO2/c1-11-13-6-12-7-15(11,2)10-16(8-12,9-13)19-14(18)4-3-5-17/h11-13H,3-10H2,1-2H3