5-(1-adamantylsulfamoyl)-2-chloranyl-benzoate

Systemtic Name: 5-(1-adamantylsulfamoyl)-2-chloranyl-benzoate Openeye Name: 5-(1-adamantylsulfamoyl)-2-chloro-benzoate CAS Name: 5-(1-adamantylsulfamoyl)-2-chlorobenzoate IUPAC Name: 5-(1-adamantylsulfamoyl)-2-chlorobenzoate Traditional Name: 5-(1-adamantylsulfamoyl)-2-chloro-benzoate Formula: C17H19ClNO4S- MolecularWeight: 368.85506

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NS(=O)(=O)C4=CC(=C(C=C4)Cl)C(=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NS(=O)(=O)C4=CC(=C(C=C4)Cl)C(=O)[O-]

InChI

InChI=1S/C17H20ClNO4S/c18-15-2-1-13(6-14(15)16(20)21)24(22,23)19-17-7-10-3-11(8-17)5-12(4-10)9-17/h1-2,6,10-12,19H,3-5,7-9H2,(H,20,21)/p-1