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

Systemtic Name: 2-[2-[4-chloranyl-3-(oxan-4-ylsulfamoyl)phenyl]-1H-indol-3-yl]ethanoic acid Openeye Name: 2-[2-[4-chloro-3-(tetrahydropyran-4-ylsulfamoyl)phenyl]-1H-indol-3-yl]acetic acid CAS Name: 2-[2-[4-chloro-3-(4-oxanylsulfamoyl)phenyl]-1H-indol-3-yl]acetic acid IUPAC Name: 2-[2-[4-chloro-3-(oxan-4-ylsulfamoyl)phenyl]-1H-indol-3-yl]acetic acid Traditional Name: 2-[2-[4-chloro-3-(tetrahydropyran-4-ylsulfamoyl)phenyl]-1H-indol-3-yl]acetic acid Formula: C21H21ClN2O5S MolecularWeight: 448.91984

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1NS(=O)(=O)C2=C(C=CC(=C2)C3=C(C4=CC=CC=C4N3)CC(=O)O)Cl

Isomeric SMILES

C1COCCC1NS(=O)(=O)C2=C(C=CC(=C2)C3=C(C4=CC=CC=C4N3)CC(=O)O)Cl

InChI

InChI=1S/C21H21ClN2O5S/c22-17-6-5-13(11-19(17)30(27,28)24-14-7-9-29-10-8-14)21-16(12-20(25)26)15-3-1-2-4-18(15)23-21/h1-6,11,14,23-24H,7-10,12H2,(H,25,26)