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5-(1-adamantylsulfamoyl)-2-(carboxyamino)benzoic acid

5-(1-adamantylsulfamoyl)-2-(carboxyamino)benzoic acid

Systemtic Name:5-(1-adamantylsulfamoyl)-2-(carboxyamino)benzoic acid
Openeye Name:5-(1-adamantylsulfamoyl)-2-(carboxyamino)benzoic acid
CAS Name:5-(1-adamantylsulfamoyl)-2-(carboxyamino)benzoic acid
IUPAC Name:5-(1-adamantylsulfamoyl)-2-(carboxyamino)benzoic acid
Traditional Name:5-(1-adamantylsulfamoyl)-2-(carboxyamino)benzoic acid
Formula: C18H22N2O6S
MolecularWeight: 394.44208
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C18H22N2O6S/c21-16(22)14-6-13(1-2-15(14)19-17(23)24)27(25,26)20-18-7-10-3-11(8-18)5-12(4-10)9-18/h1-2,6,10-12,19-20H,3-5,7-9H2,(H,21,22)(H,23,24)


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