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

Systemtic Name: 2-[3-[4-[2-(cyclopropylmethyl)-4-phenoxy-phenoxy]butoxy]phenyl]ethanoic acid Openeye Name: 2-[3-[4-[2-(cyclopropylmethyl)-4-phenoxy-phenoxy]butoxy]phenyl]acetic acid CAS Name: 2-[3-[4-[2-(cyclopropylmethyl)-4-phenoxyphenoxy]butoxy]phenyl]acetic acid IUPAC Name: 2-[3-[4-[2-(cyclopropylmethyl)-4-phenoxyphenoxy]butoxy]phenyl]acetic acid Traditional Name: 2-[3-[4-[2-(cyclopropylmethyl)-4-phenoxy-phenoxy]butoxy]phenyl]acetic acid Formula: C28H30O5 MolecularWeight: 446.5348

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CC2=C(C=CC(=C2)OC3=CC=CC=C3)OCCCCOC4=CC=CC(=C4)CC(=O)O

Isomeric SMILES

C1CC1CC2=C(C=CC(=C2)OC3=CC=CC=C3)OCCCCOC4=CC=CC(=C4)CC(=O)O

InChI

InChI=1S/C28H30O5/c29-28(30)19-22-7-6-10-25(18-22)31-15-4-5-16-32-27-14-13-26(20-23(27)17-21-11-12-21)33-24-8-2-1-3-9-24/h1-3,6-10,13-14,18,20-21H,4-5,11-12,15-17,19H2,(H,29,30)