hexyl (2S)-2-(4-chloranyl-2-methyl-phenoxy)propanoate

Systemtic Name: hexyl (2S)-2-(4-chloranyl-2-methyl-phenoxy)propanoate Openeye Name: hexyl (2S)-2-(4-chloro-2-methyl-phenoxy)propanoate CAS Name: (2S)-2-(4-chloro-2-methylphenoxy)propanoic acid hexyl ester IUPAC Name: hexyl (2S)-2-(4-chloro-2-methylphenoxy)propanoate Traditional Name: (2S)-2-(4-chloro-2-methyl-phenoxy)propionic acid hexyl ester Formula: C16H23ClO3 MolecularWeight: 298.80502

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C(C)OC1=C(C=C(C=C1)Cl)C

Isomeric SMILES

CCCCCCOC(=O)[C@H](C)OC1=C(C=C(C=C1)Cl)C

InChI

InChI=1S/C16H23ClO3/c1-4-5-6-7-10-19-16(18)13(3)20-15-9-8-14(17)11-12(15)2/h8-9,11,13H,4-7,10H2,1-3H3/t13-/m0/s1