[(2S)-octan-2-yl] 2-[2,4-bis(chloranyl)phenoxy]ethanoate

Systemtic Name: [(2S)-octan-2-yl] 2-[2,4-bis(chloranyl)phenoxy]ethanoate Openeye Name: [(1S)-1-methylheptyl] 2-(2,4-dichlorophenoxy)acetate CAS Name: 2-(2,4-dichlorophenoxy)acetic acid [(2S)-octan-2-yl] ester IUPAC Name: [(2S)-octan-2-yl] 2-(2,4-dichlorophenoxy)acetate Traditional Name: 2-(2,4-dichlorophenoxy)acetic acid [(1S)-1-methylheptyl] ester Formula: C16H22Cl2O3 MolecularWeight: 333.25008

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC(=O)COC1=C(C=C(C=C1)Cl)Cl

Isomeric SMILES

CCCCCC[C@H](C)OC(=O)COC1=C(C=C(C=C1)Cl)Cl

InChI

InChI=1S/C16H22Cl2O3/c1-3-4-5-6-7-12(2)21-16(19)11-20-15-9-8-13(17)10-14(15)18/h8-10,12H,3-7,11H2,1-2H3/t12-/m0/s1