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

Systemtic Name: 2-[3-bromanyl-4-[(3-hexyl-1H-indol-5-yl)oxy]-5-methyl-phenoxy]ethanoic acid Openeye Name: 2-[3-bromo-4-[(3-hexyl-1H-indol-5-yl)oxy]-5-methyl-phenoxy]acetic acid CAS Name: 2-[3-bromo-4-[(3-hexyl-1H-indol-5-yl)oxy]-5-methylphenoxy]acetic acid IUPAC Name: 2-[3-bromo-4-[(3-hexyl-1H-indol-5-yl)oxy]-5-methylphenoxy]acetic acid Traditional Name: 2-[3-bromo-4-[(3-hexyl-1H-indol-5-yl)oxy]-5-methyl-phenoxy]acetic acid Formula: C23H26BrNO4 MolecularWeight: 460.36084

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CNC2=C1C=C(C=C2)OC3=C(C=C(C=C3C)OCC(=O)O)Br

Isomeric SMILES

CCCCCCC1=CNC2=C1C=C(C=C2)OC3=C(C=C(C=C3C)OCC(=O)O)Br

InChI

InChI=1S/C23H26BrNO4/c1-3-4-5-6-7-16-13-25-21-9-8-17(11-19(16)21)29-23-15(2)10-18(12-20(23)24)28-14-22(26)27/h8-13,25H,3-7,14H2,1-2H3,(H,26,27)