8-(4-chloranylphenoxy)-2,2-dimethyl-octanoic acid

Systemtic Name: 8-(4-chloranylphenoxy)-2,2-dimethyl-octanoic acid Openeye Name: 8-(4-chlorophenoxy)-2,2-dimethyl-octanoic acid CAS Name: 8-(4-chlorophenoxy)-2,2-dimethyloctanoic acid IUPAC Name: 8-(4-chlorophenoxy)-2,2-dimethyloctanoic acid Traditional Name: 8-(4-chlorophenoxy)-2,2-dimethyl-caprylic acid Formula: C16H23ClO3 MolecularWeight: 298.80502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCCCCCOC1=CC=C(C=C1)Cl)C(=O)O

Isomeric SMILES

CC(C)(CCCCCCOC1=CC=C(C=C1)Cl)C(=O)O

InChI

InChI=1S/C16H23ClO3/c1-16(2,15(18)19)11-5-3-4-6-12-20-14-9-7-13(17)8-10-14/h7-10H,3-6,11-12H2,1-2H3,(H,18,19)