3-[[6-(morpholin-4-ylsulfamoyl)-5-oxidanyl-naphthalen-1-yl]sulfamoyl]benzenesulfonic acid

Systemtic Name: 3-[[6-(morpholin-4-ylsulfamoyl)-5-oxidanyl-naphthalen-1-yl]sulfamoyl]benzenesulfonic acid Openeye Name: 3-[[5-hydroxy-6-(morpholinosulfamoyl)-1-naphthyl]sulfamoyl]benzenesulfonic acid CAS Name: 3-[[5-hydroxy-6-(4-morpholinylsulfamoyl)-1-naphthalenyl]sulfamoyl]benzenesulfonic acid IUPAC Name: 3-[[5-hydroxy-6-(morpholin-4-ylsulfamoyl)naphthalen-1-yl]sulfamoyl]benzenesulfonic acid Traditional Name: 3-[[5-hydroxy-6-(morpholinosulfamoyl)-1-naphthyl]sulfamoyl]besylic acid Formula: C20H21N3O9S3 MolecularWeight: 543.59044

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1NS(=O)(=O)C2=C(C3=C(C=C2)C(=CC=C3)NS(=O)(=O)C4=CC(=CC=C4)S(=O)(=O)O)O

Isomeric SMILES

C1COCCN1NS(=O)(=O)C2=C(C3=C(C=C2)C(=CC=C3)NS(=O)(=O)C4=CC(=CC=C4)S(=O)(=O)O)O

InChI

InChI=1S/C20H21N3O9S3/c24-20-17-5-2-6-18(21-33(25,26)14-3-1-4-15(13-14)35(29,30)31)16(17)7-8-19(20)34(27,28)22-23-9-11-32-12-10-23/h1-8,13,21-22,24H,9-12H2,(H,29,30,31)