2-[2,5-bis(2-methylbutan-2-yl)phenoxy]ethyl 5-bromanylpentanoate

Systemtic Name: 2-[2,5-bis(2-methylbutan-2-yl)phenoxy]ethyl 5-bromanylpentanoate Openeye Name: 2-[2,5-bis(1,1-dimethylpropyl)phenoxy]ethyl 5-bromopentanoate CAS Name: 5-bromopentanoic acid 2-[2,5-bis(2-methylbutan-2-yl)phenoxy]ethyl ester IUPAC Name: 2-[2,5-bis(2-methylbutan-2-yl)phenoxy]ethyl 5-bromopentanoate Traditional Name: 5-bromovaleric acid 2-(2,5-ditert-amylphenoxy)ethyl ester Formula: C23H37BrO3 MolecularWeight: 441.44208

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC(=C(C=C1)C(C)(C)CC)OCCOC(=O)CCCCBr

Isomeric SMILES

CCC(C)(C)C1=CC(=C(C=C1)C(C)(C)CC)OCCOC(=O)CCCCBr

InChI

InChI=1S/C23H37BrO3/c1-7-22(3,4)18-12-13-19(23(5,6)8-2)20(17-18)26-15-16-27-21(25)11-9-10-14-24/h12-13,17H,7-11,14-16H2,1-6H3