9-[2-azanyl-1-[4-(2,6-dimethylphenoxy)-3-fluoranyl-phenyl]-1-oxidanyl-2-oxidanylidene-ethoxy]nonanoic acid

Systemtic Name: 9-[2-azanyl-1-[4-(2,6-dimethylphenoxy)-3-fluoranyl-phenyl]-1-oxidanyl-2-oxidanylidene-ethoxy]nonanoic acid Openeye Name: 9-[2-amino-1-[4-(2,6-dimethylphenoxy)-3-fluoro-phenyl]-1-hydroxy-2-oxo-ethoxy]nonanoic acid CAS Name: 9-[2-amino-1-[4-(2,6-dimethylphenoxy)-3-fluorophenyl]-1-hydroxy-2-oxoethoxy]nonanoic acid IUPAC Name: 9-[2-amino-1-[4-(2,6-dimethylphenoxy)-3-fluorophenyl]-1-hydroxy-2-oxoethoxy]nonanoic acid Traditional Name: 9-[2-amino-1-[4-(2,6-dimethylphenoxy)-3-fluoro-phenyl]-1-hydroxy-2-keto-ethoxy]pelargonic acid Formula: C25H32FNO6 MolecularWeight: 461.523083

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OC2=C(C=C(C=C2)C(C(=O)N)(O)OCCCCCCCCC(=O)O)F

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC2=C(C=C(C=C2)C(C(=O)N)(O)OCCCCCCCCC(=O)O)F

InChI

InChI=1S/C25H32FNO6/c1-17-10-9-11-18(2)23(17)33-21-14-13-19(16-20(21)26)25(31,24(27)30)32-15-8-6-4-3-5-7-12-22(28)29/h9-11,13-14,16,31H,3-8,12,15H2,1-2H3,(H2,27,30)(H,28,29)