methyl 4-bromanyl-2-chloranyl-2-methyl-octanoate

Systemtic Name: methyl 4-bromanyl-2-chloranyl-2-methyl-octanoate Openeye Name: methyl 4-bromo-2-chloro-2-methyl-octanoate CAS Name: 4-bromo-2-chloro-2-methyloctanoic acid methyl ester IUPAC Name: methyl 4-bromo-2-chloro-2-methyloctanoate Traditional Name: 4-bromo-2-chloro-2-methyl-caprylic acid methyl ester Formula: C10H18BrClO2 MolecularWeight: 285.60572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(C)(C(=O)OC)Cl)Br

Isomeric SMILES

CCCCC(CC(C)(C(=O)OC)Cl)Br

InChI

InChI=1S/C10H18BrClO2/c1-4-5-6-8(11)7-10(2,12)9(13)14-3/h8H,4-7H2,1-3H3