[3,5-dimethyl-2-(3-methyl-1-oxidanyl-butyl)phenyl] 4-bromanylbutanoate

Systemtic Name: [3,5-dimethyl-2-(3-methyl-1-oxidanyl-butyl)phenyl] 4-bromanylbutanoate Openeye Name: [2-(1-hydroxy-3-methyl-butyl)-3,5-dimethyl-phenyl] 4-bromobutanoate CAS Name: 4-bromobutanoic acid [2-(1-hydroxy-3-methylbutyl)-3,5-dimethylphenyl] ester IUPAC Name: [2-(1-hydroxy-3-methylbutyl)-3,5-dimethylphenyl] 4-bromobutanoate Traditional Name: 4-bromobutyric acid [2-(1-hydroxy-3-methyl-butyl)-3,5-dimethyl-phenyl] ester Formula: C17H25BrO3 MolecularWeight: 357.2826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OC(=O)CCCBr)C(CC(C)C)O)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OC(=O)CCCBr)C(CC(C)C)O)C

InChI

InChI=1S/C17H25BrO3/c1-11(2)8-14(19)17-13(4)9-12(3)10-15(17)21-16(20)6-5-7-18/h9-11,14,19H,5-8H2,1-4H3