(3,3,5-trimethylcyclohexyl) 2-(2-chloranylphenoxy)-3-methyl-butanoate

Systemtic Name: (3,3,5-trimethylcyclohexyl) 2-(2-chloranylphenoxy)-3-methyl-butanoate Openeye Name: (3,3,5-trimethylcyclohexyl) 2-(2-chlorophenoxy)-3-methyl-butanoate CAS Name: 2-(2-chlorophenoxy)-3-methylbutanoic acid (3,3,5-trimethylcyclohexyl) ester IUPAC Name: (3,3,5-trimethylcyclohexyl) 2-(2-chlorophenoxy)-3-methylbutanoate Traditional Name: 2-(2-chlorophenoxy)-3-methyl-butyric acid (3,3,5-trimethylcyclohexyl) ester Formula: C20H29ClO3 MolecularWeight: 352.89546

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CC(C1)(C)C)OC(=O)C(C(C)C)OC2=CC=CC=C2Cl

Isomeric SMILES

CC1CC(CC(C1)(C)C)OC(=O)C(C(C)C)OC2=CC=CC=C2Cl

InChI

InChI=1S/C20H29ClO3/c1-13(2)18(24-17-9-7-6-8-16(17)21)19(22)23-15-10-14(3)11-20(4,5)12-15/h6-9,13-15,18H,10-12H2,1-5H3