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

Systemtic Name: 2-[3-bromanyl-4-[(3-hexyl-1H-indol-5-yl)oxy]-5-methyl-phenyl]ethanoic acid Openeye Name: 2-[3-bromo-4-[(3-hexyl-1H-indol-5-yl)oxy]-5-methyl-phenyl]acetic acid CAS Name: 2-[3-bromo-4-[(3-hexyl-1H-indol-5-yl)oxy]-5-methylphenyl]acetic acid IUPAC Name: 2-[3-bromo-4-[(3-hexyl-1H-indol-5-yl)oxy]-5-methylphenyl]acetic acid Traditional Name: 2-[3-bromo-4-[(3-hexyl-1H-indol-5-yl)oxy]-5-methyl-phenyl]acetic acid Formula: C23H26BrNO3 MolecularWeight: 444.36144

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CNC2=C1C=C(C=C2)OC3=C(C=C(C=C3Br)CC(=O)O)C

Isomeric SMILES

CCCCCCC1=CNC2=C1C=C(C=C2)OC3=C(C=C(C=C3Br)CC(=O)O)C

InChI

InChI=1S/C23H26BrNO3/c1-3-4-5-6-7-17-14-25-21-9-8-18(13-19(17)21)28-23-15(2)10-16(11-20(23)24)12-22(26)27/h8-11,13-14,25H,3-7,12H2,1-2H3,(H,26,27)