4-(1-adamantylcarbonylsulfamoyl)benzoic acid

Systemtic Name: 4-(1-adamantylcarbonylsulfamoyl)benzoic acid Openeye Name: 4-(adamantane-1-carbonylsulfamoyl)benzoic acid CAS Name: 4-[[1-adamantyl(oxo)methyl]sulfamoyl]benzoic acid IUPAC Name: 4-(adamantane-1-carbonylsulfamoyl)benzoic acid Traditional Name: 4-(adamantane-1-carbonylsulfamoyl)benzoic acid Formula: C18H21NO5S MolecularWeight: 363.42804

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NS(=O)(=O)C4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)NS(=O)(=O)C4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C18H21NO5S/c20-16(21)14-1-3-15(4-2-14)25(23,24)19-17(22)18-8-11-5-12(9-18)7-13(6-11)10-18/h1-4,11-13H,5-10H2,(H,19,22)(H,20,21)