2-[4-[4-(3-chloranyl-4-phenoxy-2-propyl-phenoxy)butoxy]phenyl]ethanoic acid

Systemtic Name: 2-[4-[4-(3-chloranyl-4-phenoxy-2-propyl-phenoxy)butoxy]phenyl]ethanoic acid Openeye Name: 2-[4-[4-(3-chloro-4-phenoxy-2-propyl-phenoxy)butoxy]phenyl]acetic acid CAS Name: 2-[4-[4-(3-chloro-4-phenoxy-2-propylphenoxy)butoxy]phenyl]acetic acid IUPAC Name: 2-[4-[4-(3-chloro-4-phenoxy-2-propylphenoxy)butoxy]phenyl]acetic acid Traditional Name: 2-[4-[4-(3-chloro-4-phenoxy-2-propyl-phenoxy)butoxy]phenyl]acetic acid Formula: C27H29ClO5 MolecularWeight: 468.96916

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1Cl)OC2=CC=CC=C2)OCCCCOC3=CC=C(C=C3)CC(=O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1Cl)OC2=CC=CC=C2)OCCCCOC3=CC=C(C=C3)CC(=O)O

InChI

InChI=1S/C27H29ClO5/c1-2-8-23-24(15-16-25(27(23)28)33-22-9-4-3-5-10-22)32-18-7-6-17-31-21-13-11-20(12-14-21)19-26(29)30/h3-5,9-16H,2,6-8,17-19H2,1H3,(H,29,30)