2-[3-[3-[2-ethyl-4-(furan-3-yl)-5-oxidanyl-phenoxy]propoxy]-2-propyl-phenoxy]benzoic acid

Systemtic Name: 2-[3-[3-[2-ethyl-4-(furan-3-yl)-5-oxidanyl-phenoxy]propoxy]-2-propyl-phenoxy]benzoic acid Openeye Name: 2-[3-[3-[2-ethyl-4-(3-furyl)-5-hydroxy-phenoxy]propoxy]-2-propyl-phenoxy]benzoic acid CAS Name: 2-[3-[3-[2-ethyl-4-(3-furanyl)-5-hydroxyphenoxy]propoxy]-2-propylphenoxy]benzoic acid IUPAC Name: 2-[3-[3-[2-ethyl-4-(furan-3-yl)-5-hydroxyphenoxy]propoxy]-2-propylphenoxy]benzoic acid Traditional Name: 2-[3-[3-[2-ethyl-4-(3-furyl)-5-hydroxy-phenoxy]propoxy]-2-propyl-phenoxy]benzoic acid Formula: C31H32O7 MolecularWeight: 516.58158

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC=C1OCCCOC2=C(C=C(C(=C2)O)C3=COC=C3)CC)OC4=CC=CC=C4C(=O)O

Isomeric SMILES

CCCC1=C(C=CC=C1OCCCOC2=C(C=C(C(=C2)O)C3=COC=C3)CC)OC4=CC=CC=C4C(=O)O

InChI

InChI=1S/C31H32O7/c1-3-9-23-27(12-7-13-28(23)38-29-11-6-5-10-24(29)31(33)34)36-15-8-16-37-30-19-26(32)25(18-21(30)4-2)22-14-17-35-20-22/h5-7,10-14,17-20,32H,3-4,8-9,15-16H2,1-2H3,(H,33,34)