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

Systemtic Name: 2-[3,5-bis(bromanyl)-4-[(3-butan-2-yl-1H-indol-5-yl)oxy]phenyl]ethanoic acid Openeye Name: 2-[3,5-dibromo-4-[(3-sec-butyl-1H-indol-5-yl)oxy]phenyl]acetic acid CAS Name: 2-[3,5-dibromo-4-[(3-butan-2-yl-1H-indol-5-yl)oxy]phenyl]acetic acid IUPAC Name: 2-[3,5-dibromo-4-[(3-butan-2-yl-1H-indol-5-yl)oxy]phenyl]acetic acid Traditional Name: 2-[3,5-dibromo-4-[(3-sec-butyl-1H-indol-5-yl)oxy]phenyl]acetic acid Formula: C20H19Br2NO3 MolecularWeight: 481.17776

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CNC2=C1C=C(C=C2)OC3=C(C=C(C=C3Br)CC(=O)O)Br

Isomeric SMILES

CCC(C)C1=CNC2=C1C=C(C=C2)OC3=C(C=C(C=C3Br)CC(=O)O)Br

InChI

InChI=1S/C20H19Br2NO3/c1-3-11(2)15-10-23-18-5-4-13(9-14(15)18)26-20-16(21)6-12(7-17(20)22)8-19(24)25/h4-7,9-11,23H,3,8H2,1-2H3,(H,24,25)