methyl 2-butyl-2-chloranyl-5-methyl-3-oxidanyl-hexanoate

Systemtic Name: methyl 2-butyl-2-chloranyl-5-methyl-3-oxidanyl-hexanoate Openeye Name: methyl 2-butyl-2-chloro-3-hydroxy-5-methyl-hexanoate CAS Name: 2-butyl-2-chloro-3-hydroxy-5-methylhexanoic acid methyl ester IUPAC Name: methyl 2-butyl-2-chloro-3-hydroxy-5-methylhexanoate Traditional Name: 2-butyl-2-chloro-3-hydroxy-5-methyl-hexanoic acid methyl ester Formula: C12H23ClO3 MolecularWeight: 250.76222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H23ClO3/c1-5-6-7-12(13,11(15)16-4)10(14)8-9(2)3/h9-10,14H,5-8H2,1-4H3