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

Systemtic Name: 2-[3,5-bis(bromanyl)-4-[(3-pentyl-1H-indol-5-yl)oxy]phenyl]ethanoic acid Openeye Name: 2-[3,5-dibromo-4-[(3-pentyl-1H-indol-5-yl)oxy]phenyl]acetic acid CAS Name: 2-[3,5-dibromo-4-[(3-pentyl-1H-indol-5-yl)oxy]phenyl]acetic acid IUPAC Name: 2-[3,5-dibromo-4-[(3-pentyl-1H-indol-5-yl)oxy]phenyl]acetic acid Traditional Name: 2-[4-[(3-amyl-1H-indol-5-yl)oxy]-3,5-dibromo-phenyl]acetic acid Formula: C21H21Br2NO3 MolecularWeight: 495.20434

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CNC2=C1C=C(C=C2)OC3=C(C=C(C=C3Br)CC(=O)O)Br

Isomeric SMILES

CCCCCC1=CNC2=C1C=C(C=C2)OC3=C(C=C(C=C3Br)CC(=O)O)Br

InChI

InChI=1S/C21H21Br2NO3/c1-2-3-4-5-14-12-24-19-7-6-15(11-16(14)19)27-21-17(22)8-13(9-18(21)23)10-20(25)26/h6-9,11-12,24H,2-5,10H2,1H3,(H,25,26)