2-[3,5-bis(bromanyl)-4-[(3-hexyl-1H-indol-5-yl)oxy]phenoxy]ethanoic acid

Systemtic Name: 2-[3,5-bis(bromanyl)-4-[(3-hexyl-1H-indol-5-yl)oxy]phenoxy]ethanoic acid Openeye Name: 2-[3,5-dibromo-4-[(3-hexyl-1H-indol-5-yl)oxy]phenoxy]acetic acid CAS Name: 2-[3,5-dibromo-4-[(3-hexyl-1H-indol-5-yl)oxy]phenoxy]acetic acid IUPAC Name: 2-[3,5-dibromo-4-[(3-hexyl-1H-indol-5-yl)oxy]phenoxy]acetic acid Traditional Name: 2-[3,5-dibromo-4-[(3-hexyl-1H-indol-5-yl)oxy]phenoxy]acetic acid Formula: C22H23Br2NO4 MolecularWeight: 525.23032

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CNC2=C1C=C(C=C2)OC3=C(C=C(C=C3Br)OCC(=O)O)Br

Isomeric SMILES

CCCCCCC1=CNC2=C1C=C(C=C2)OC3=C(C=C(C=C3Br)OCC(=O)O)Br

InChI

InChI=1S/C22H23Br2NO4/c1-2-3-4-5-6-14-12-25-20-8-7-15(9-17(14)20)29-22-18(23)10-16(11-19(22)24)28-13-21(26)27/h7-12,25H,2-6,13H2,1H3,(H,26,27)