2-[3-bromanyl-4-[(3-butyl-1H-indol-5-yl)oxy]-5-(trifluoromethyl)phenoxy]ethanoic acid

Systemtic Name: 2-[3-bromanyl-4-[(3-butyl-1H-indol-5-yl)oxy]-5-(trifluoromethyl)phenoxy]ethanoic acid Openeye Name: 2-[3-bromo-4-[(3-butyl-1H-indol-5-yl)oxy]-5-(trifluoromethyl)phenoxy]acetic acid CAS Name: 2-[3-bromo-4-[(3-butyl-1H-indol-5-yl)oxy]-5-(trifluoromethyl)phenoxy]acetic acid IUPAC Name: 2-[3-bromo-4-[(3-butyl-1H-indol-5-yl)oxy]-5-(trifluoromethyl)phenoxy]acetic acid Traditional Name: 2-[3-bromo-4-[(3-butyl-1H-indol-5-yl)oxy]-5-(trifluoromethyl)phenoxy]acetic acid Formula: C21H19BrF3NO4 MolecularWeight: 486.27907

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CNC2=C1C=C(C=C2)OC3=C(C=C(C=C3C(F)(F)F)OCC(=O)O)Br

Isomeric SMILES

CCCCC1=CNC2=C1C=C(C=C2)OC3=C(C=C(C=C3C(F)(F)F)OCC(=O)O)Br

InChI

InChI=1S/C21H19BrF3NO4/c1-2-3-4-12-10-26-18-6-5-13(7-15(12)18)30-20-16(21(23,24)25)8-14(9-17(20)22)29-11-19(27)28/h5-10,26H,2-4,11H2,1H3,(H,27,28)