2-[2-(2-methylphenyl)ethyl]-3-oxidanyl-2-[3-(thiophen-3-ylmethoxy)phenoxy]butanoic acid

Systemtic Name: 2-[2-(2-methylphenyl)ethyl]-3-oxidanyl-2-[3-(thiophen-3-ylmethoxy)phenoxy]butanoic acid Openeye Name: 3-hydroxy-2-[2-(o-tolyl)ethyl]-2-[3-(3-thienylmethoxy)phenoxy]butanoic acid CAS Name: 3-hydroxy-2-[2-(2-methylphenyl)ethyl]-2-[3-(3-thiophenylmethoxy)phenoxy]butanoic acid IUPAC Name: 3-hydroxy-2-[2-(2-methylphenyl)ethyl]-2-[3-(thiophen-3-ylmethoxy)phenoxy]butanoic acid Traditional Name: 3-hydroxy-2-[2-(o-tolyl)ethyl]-2-[3-(3-thenyloxy)phenoxy]butyric acid Formula: C24H26O5S MolecularWeight: 426.52524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CCC(C(C)O)(C(=O)O)OC2=CC=CC(=C2)OCC3=CSC=C3

Isomeric SMILES

CC1=CC=CC=C1CCC(C(C)O)(C(=O)O)OC2=CC=CC(=C2)OCC3=CSC=C3

InChI

InChI=1S/C24H26O5S/c1-17-6-3-4-7-20(17)10-12-24(18(2)25,23(26)27)29-22-9-5-8-21(14-22)28-15-19-11-13-30-16-19/h3-9,11,13-14,16,18,25H,10,12,15H2,1-2H3,(H,26,27)