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

Systemtic Name: 2-[3-bromanyl-5-methyl-4-[(3-pentyl-1H-indol-5-yl)oxy]phenoxy]ethanoic acid Openeye Name: 2-[3-bromo-5-methyl-4-[(3-pentyl-1H-indol-5-yl)oxy]phenoxy]acetic acid CAS Name: 2-[3-bromo-5-methyl-4-[(3-pentyl-1H-indol-5-yl)oxy]phenoxy]acetic acid IUPAC Name: 2-[3-bromo-5-methyl-4-[(3-pentyl-1H-indol-5-yl)oxy]phenoxy]acetic acid Traditional Name: 2-[4-[(3-amyl-1H-indol-5-yl)oxy]-3-bromo-5-methyl-phenoxy]acetic acid Formula: C22H24BrNO4 MolecularWeight: 446.33426

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CNC2=C1C=C(C=C2)OC3=C(C=C(C=C3C)OCC(=O)O)Br

Isomeric SMILES

CCCCCC1=CNC2=C1C=C(C=C2)OC3=C(C=C(C=C3C)OCC(=O)O)Br

InChI

InChI=1S/C22H24BrNO4/c1-3-4-5-6-15-12-24-20-8-7-16(10-18(15)20)28-22-14(2)9-17(11-19(22)23)27-13-21(25)26/h7-12,24H,3-6,13H2,1-2H3,(H,25,26)