3-[3-chloranyl-4-[3-(4-phenoxyphenoxy)propoxy]phenyl]-2-methoxy-propanoic acid

Systemtic Name: 3-[3-chloranyl-4-[3-(4-phenoxyphenoxy)propoxy]phenyl]-2-methoxy-propanoic acid Openeye Name: 3-[3-chloro-4-[3-(4-phenoxyphenoxy)propoxy]phenyl]-2-methoxy-propanoic acid CAS Name: 3-[3-chloro-4-[3-(4-phenoxyphenoxy)propoxy]phenyl]-2-methoxypropanoic acid IUPAC Name: 3-[3-chloro-4-[3-(4-phenoxyphenoxy)propoxy]phenyl]-2-methoxypropanoic acid Traditional Name: 3-[3-chloro-4-[3-(4-phenoxyphenoxy)propoxy]phenyl]-2-methoxy-propionic acid Formula: C25H25ClO6 MolecularWeight: 456.9154

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Descriptors Computed from Structure

Canonical SMILES:

COC(CC1=CC(=C(C=C1)OCCCOC2=CC=C(C=C2)OC3=CC=CC=C3)Cl)C(=O)O

Isomeric SMILES

COC(CC1=CC(=C(C=C1)OCCCOC2=CC=C(C=C2)OC3=CC=CC=C3)Cl)C(=O)O

InChI

InChI=1S/C25H25ClO6/c1-29-24(25(27)28)17-18-8-13-23(22(26)16-18)31-15-5-14-30-19-9-11-21(12-10-19)32-20-6-3-2-4-7-20/h2-4,6-13,16,24H,5,14-15,17H2,1H3,(H,27,28)