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

Systemtic Name: 2-[3-bromanyl-4-[(3-butyl-1H-indol-5-yl)oxy]-5-chloranyl-phenoxy]ethanoic acid Openeye Name: 2-[3-bromo-4-[(3-butyl-1H-indol-5-yl)oxy]-5-chloro-phenoxy]acetic acid CAS Name: 2-[3-bromo-4-[(3-butyl-1H-indol-5-yl)oxy]-5-chlorophenoxy]acetic acid IUPAC Name: 2-[3-bromo-4-[(3-butyl-1H-indol-5-yl)oxy]-5-chlorophenoxy]acetic acid Traditional Name: 2-[3-bromo-4-[(3-butyl-1H-indol-5-yl)oxy]-5-chloro-phenoxy]acetic acid Formula: C20H19BrClNO4 MolecularWeight: 452.72616

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CNC2=C1C=C(C=C2)OC3=C(C=C(C=C3Br)OCC(=O)O)Cl

Isomeric SMILES

CCCCC1=CNC2=C1C=C(C=C2)OC3=C(C=C(C=C3Br)OCC(=O)O)Cl

InChI

InChI=1S/C20H19BrClNO4/c1-2-3-4-12-10-23-18-6-5-13(7-15(12)18)27-20-16(21)8-14(9-17(20)22)26-11-19(24)25/h5-10,23H,2-4,11H2,1H3,(H,24,25)