2-[2-(4-chloranyl-3-hexyl-2-sulfamoyl-phenyl)-1H-indol-3-yl]ethanoic acid

Systemtic Name: 2-[2-(4-chloranyl-3-hexyl-2-sulfamoyl-phenyl)-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-(4-chloro-3-hexyl-2-sulfamoyl-phenyl)-1H-indol-3-yl]acetic acid CAS Name: 2-[2-(4-chloro-3-hexyl-2-sulfamoylphenyl)-1H-indol-3-yl]acetic acid IUPAC Name: 2-[2-(4-chloro-3-hexyl-2-sulfamoylphenyl)-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-(4-chloro-3-hexyl-2-sulfamoyl-phenyl)-1H-indol-3-yl]acetic acid Formula: C22H25ClN2O4S MolecularWeight: 448.9629

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=CC(=C1S(=O)(=O)N)C2=C(C3=CC=CC=C3N2)CC(=O)O)Cl

Isomeric SMILES

CCCCCCC1=C(C=CC(=C1S(=O)(=O)N)C2=C(C3=CC=CC=C3N2)CC(=O)O)Cl

InChI

InChI=1S/C22H25ClN2O4S/c1-2-3-4-5-9-15-18(23)12-11-16(22(15)30(24,28)29)21-17(13-20(26)27)14-8-6-7-10-19(14)25-21/h6-8,10-12,25H,2-5,9,13H2,1H3,(H,26,27)(H2,24,28,29)