3-[(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)sulfamoyl]benzoic acid

Systemtic Name: 3-[(2-chloranyl-5-morpholin-4-ylsulfonyl-phenyl)sulfamoyl]benzoic acid Openeye Name: 3-[(2-chloro-5-morpholinosulfonyl-phenyl)sulfamoyl]benzoic acid CAS Name: 3-[[2-chloro-5-(4-morpholinylsulfonyl)phenyl]sulfamoyl]benzoic acid IUPAC Name: 3-[(2-chloro-5-morpholin-4-ylsulfonylphenyl)sulfamoyl]benzoic acid Traditional Name: 3-[(2-chloro-5-morpholinosulfonyl-phenyl)sulfamoyl]benzoic acid Formula: C17H17ClN2O7S2 MolecularWeight: 460.90908

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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