3-[(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)sulfamoyl]benzoic acid

Systemtic Name: 3-[(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)sulfamoyl]benzoic acid Openeye Name: 3-[(4-chloro-3-morpholinosulfonyl-phenyl)sulfamoyl]benzoic acid CAS Name: 3-[[4-chloro-3-(4-morpholinylsulfonyl)phenyl]sulfamoyl]benzoic acid IUPAC Name: 3-[(4-chloro-3-morpholin-4-ylsulfonylphenyl)sulfamoyl]benzoic acid Traditional Name: 3-[(4-chloro-3-morpholinosulfonyl-phenyl)sulfamoyl]benzoic acid Formula: C17H17ClN2O7S2 MolecularWeight: 460.90908

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)NS(=O)(=O)C3=CC=CC(=C3)C(=O)O)Cl

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=C(C=CC(=C2)NS(=O)(=O)C3=CC=CC(=C3)C(=O)O)Cl

InChI

InChI=1S/C17H17ClN2O7S2/c18-15-5-4-13(11-16(15)29(25,26)20-6-8-27-9-7-20)19-28(23,24)14-3-1-2-12(10-14)17(21)22/h1-5,10-11,19H,6-9H2,(H,21,22)