heptan-2-yl 2-(4-chloranyl-2-methyl-phenoxy)ethanoate

Systemtic Name: heptan-2-yl 2-(4-chloranyl-2-methyl-phenoxy)ethanoate Openeye Name: 1-methylhexyl 2-(4-chloro-2-methyl-phenoxy)acetate CAS Name: 2-(4-chloro-2-methylphenoxy)acetic acid heptan-2-yl ester IUPAC Name: heptan-2-yl 2-(4-chloro-2-methylphenoxy)acetate Traditional Name: 2-(4-chloro-2-methyl-phenoxy)acetic acid 1-methylhexyl ester Formula: C16H23ClO3 MolecularWeight: 298.80502

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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