4-methoxy-3-[(3-morpholin-4-ylsulfonylphenyl)sulfamoyl]benzoic acid

Systemtic Name: 4-methoxy-3-[(3-morpholin-4-ylsulfonylphenyl)sulfamoyl]benzoic acid Openeye Name: 4-methoxy-3-[(3-morpholinosulfonylphenyl)sulfamoyl]benzoic acid CAS Name: 4-methoxy-3-[[3-(4-morpholinylsulfonyl)phenyl]sulfamoyl]benzoic acid IUPAC Name: 4-methoxy-3-[(3-morpholin-4-ylsulfonylphenyl)sulfamoyl]benzoic acid Traditional Name: 4-methoxy-3-[(3-morpholinosulfonylphenyl)sulfamoyl]benzoic acid Formula: C18H20N2O8S2 MolecularWeight: 456.49

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C18H20N2O8S2/c1-27-16-6-5-13(18(21)22)11-17(16)29(23,24)19-14-3-2-4-15(12-14)30(25,26)20-7-9-28-10-8-20/h2-6,11-12,19H,7-10H2,1H3,(H,21,22)