2-[4-[3-(4-chloranyl-2-phenoxy-phenoxy)phenoxy]-2-methyl-phenoxy]-2-methyl-propanoic acid

Systemtic Name: 2-[4-[3-(4-chloranyl-2-phenoxy-phenoxy)phenoxy]-2-methyl-phenoxy]-2-methyl-propanoic acid Openeye Name: 2-[4-[3-(4-chloro-2-phenoxy-phenoxy)phenoxy]-2-methyl-phenoxy]-2-methyl-propanoic acid CAS Name: 2-[4-[3-(4-chloro-2-phenoxyphenoxy)phenoxy]-2-methylphenoxy]-2-methylpropanoic acid IUPAC Name: 2-[4-[3-(4-chloro-2-phenoxyphenoxy)phenoxy]-2-methylphenoxy]-2-methylpropanoic acid Traditional Name: 2-[4-[3-(4-chloro-2-phenoxy-phenoxy)phenoxy]-2-methyl-phenoxy]-2-methyl-propionic acid Formula: C29H25ClO6 MolecularWeight: 504.9582

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=CC(=CC=C2)OC3=C(C=C(C=C3)Cl)OC4=CC=CC=C4)OC(C)(C)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=CC(=CC=C2)OC3=C(C=C(C=C3)Cl)OC4=CC=CC=C4)OC(C)(C)C(=O)O

InChI

InChI=1S/C29H25ClO6/c1-19-16-24(13-15-25(19)36-29(2,3)28(31)32)33-22-10-7-11-23(18-22)35-26-14-12-20(30)17-27(26)34-21-8-5-4-6-9-21/h4-18H,1-3H3,(H,31,32)