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4-chloranyl-2-(cyclohexylamino)-5-(diethylsulfamoyl)benzoic acid

4-chloranyl-2-(cyclohexylamino)-5-(diethylsulfamoyl)benzoic acid

Systemtic Name:4-chloranyl-2-(cyclohexylamino)-5-(diethylsulfamoyl)benzoic acid
Openeye Name:4-chloro-2-(cyclohexylamino)-5-(diethylsulfamoyl)benzoic acid
CAS Name:4-chloro-2-(cyclohexylamino)-5-(diethylsulfamoyl)benzoic acid
IUPAC Name:4-chloro-2-(cyclohexylamino)-5-(diethylsulfamoyl)benzoic acid
Traditional Name:4-chloro-2-(cyclohexylamino)-5-(diethylsulfamoyl)benzoic acid
Formula: C17H25ClN2O4S
MolecularWeight: 388.9094
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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=C(C=C(C(=C1)C(=O)O)NC2CCCCC2)Cl


Isomeric SMILES

CCN(CC)S(=O)(=O)C1=C(C=C(C(=C1)C(=O)O)NC2CCCCC2)Cl


InChI

InChI=1S/C17H25ClN2O4S/c1-3-20(4-2)25(23,24)16-10-13(17(21)22)15(11-14(16)18)19-12-8-6-5-7-9-12/h10-12,19H,3-9H2,1-2H3,(H,21,22)


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