2-[4-[(3R)-3-(4-chloranyl-2-phenoxy-phenoxy)butoxy]-2-methyl-phenoxy]ethanoic acid

Systemtic Name: 2-[4-[(3R)-3-(4-chloranyl-2-phenoxy-phenoxy)butoxy]-2-methyl-phenoxy]ethanoic acid Openeye Name: 2-[4-[(3R)-3-(4-chloro-2-phenoxy-phenoxy)butoxy]-2-methyl-phenoxy]acetic acid CAS Name: 2-[4-[(3R)-3-(4-chloro-2-phenoxyphenoxy)butoxy]-2-methylphenoxy]acetic acid IUPAC Name: 2-[4-[(3R)-3-(4-chloro-2-phenoxyphenoxy)butoxy]-2-methylphenoxy]acetic acid Traditional Name: 2-[4-[(3R)-3-(4-chloro-2-phenoxy-phenoxy)butoxy]-2-methyl-phenoxy]acetic acid Formula: C25H25ClO6 MolecularWeight: 456.9154

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCC(C)OC2=C(C=C(C=C2)Cl)OC3=CC=CC=C3)OCC(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)OCC[C@@H](C)OC2=C(C=C(C=C2)Cl)OC3=CC=CC=C3)OCC(=O)O

InChI

InChI=1S/C25H25ClO6/c1-17-14-21(9-11-22(17)30-16-25(27)28)29-13-12-18(2)31-23-10-8-19(26)15-24(23)32-20-6-4-3-5-7-20/h3-11,14-15,18H,12-13,16H2,1-2H3,(H,27,28)/t18-/m1/s1