3-chloranyl-4-[4-(diethylsulfamoyl)phenyl]sulfonyloxy-5-methoxy-benzoic acid

Systemtic Name: 3-chloranyl-4-[4-(diethylsulfamoyl)phenyl]sulfonyloxy-5-methoxy-benzoic acid Openeye Name: 3-chloro-4-[4-(diethylsulfamoyl)phenyl]sulfonyloxy-5-methoxy-benzoic acid CAS Name: 3-chloro-4-[4-(diethylsulfamoyl)phenyl]sulfonyloxy-5-methoxybenzoic acid IUPAC Name: 3-chloro-4-[4-(diethylsulfamoyl)phenyl]sulfonyloxy-5-methoxybenzoic acid Traditional Name: 3-chloro-4-[4-(diethylsulfamoyl)phenyl]sulfonyloxy-5-methoxy-benzoic acid Formula: C18H20ClNO8S2 MolecularWeight: 477.9363

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2Cl)C(=O)O)OC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2Cl)C(=O)O)OC

InChI

InChI=1S/C18H20ClNO8S2/c1-4-20(5-2)29(23,24)13-6-8-14(9-7-13)30(25,26)28-17-15(19)10-12(18(21)22)11-16(17)27-3/h6-11H,4-5H2,1-3H3,(H,21,22)