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

Systemtic Name: 2-[3,5-bis(bromanyl)-4-[(3-pyridin-4-ylsulfonyl-1H-indol-5-yl)oxy]phenyl]ethanoic acid Openeye Name: 2-[3,5-dibromo-4-[[3-(4-pyridylsulfonyl)-1H-indol-5-yl]oxy]phenyl]acetic acid CAS Name: 2-[3,5-dibromo-4-[(3-pyridin-4-ylsulfonyl-1H-indol-5-yl)oxy]phenyl]acetic acid IUPAC Name: 2-[3,5-dibromo-4-[(3-pyridin-4-ylsulfonyl-1H-indol-5-yl)oxy]phenyl]acetic acid Traditional Name: 2-[3,5-dibromo-4-[[3-(4-pyridylsulfonyl)-1H-indol-5-yl]oxy]phenyl]acetic acid Formula: C21H14Br2N2O5S MolecularWeight: 566.21926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1OC3=C(C=C(C=C3Br)CC(=O)O)Br)C(=CN2)S(=O)(=O)C4=CC=NC=C4

Isomeric SMILES

C1=CC2=C(C=C1OC3=C(C=C(C=C3Br)CC(=O)O)Br)C(=CN2)S(=O)(=O)C4=CC=NC=C4

InChI

InChI=1S/C21H14Br2N2O5S/c22-16-7-12(9-20(26)27)8-17(23)21(16)30-13-1-2-18-15(10-13)19(11-25-18)31(28,29)14-3-5-24-6-4-14/h1-8,10-11,25H,9H2,(H,26,27)