3-(tert-butylsulfamoyl)-1-[2-(oxan-2-yloxy)ethyl]indole-2-carboxylic acid

Systemtic Name: 3-(tert-butylsulfamoyl)-1-[2-(oxan-2-yloxy)ethyl]indole-2-carboxylic acid Openeye Name: 3-(tert-butylsulfamoyl)-1-(2-tetrahydropyran-2-yloxyethyl)indole-2-carboxylic acid CAS Name: 3-(tert-butylsulfamoyl)-1-[2-(2-oxanyloxy)ethyl]-2-indolecarboxylic acid IUPAC Name: 3-(tert-butylsulfamoyl)-1-[2-(oxan-2-yloxy)ethyl]indole-2-carboxylic acid Traditional Name: 3-(tert-butylsulfamoyl)-1-(2-tetrahydropyran-2-yloxyethyl)indole-2-carboxylic acid Formula: C20H28N2O6S MolecularWeight: 424.51112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=C(N(C2=CC=CC=C21)CCOC3CCCCO3)C(=O)O

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=C(N(C2=CC=CC=C21)CCOC3CCCCO3)C(=O)O

InChI

InChI=1S/C20H28N2O6S/c1-20(2,3)21-29(25,26)18-14-8-4-5-9-15(14)22(17(18)19(23)24)11-13-28-16-10-6-7-12-27-16/h4-5,8-9,16,21H,6-7,10-13H2,1-3H3,(H,23,24)