3-[1-adamantylmethyl(methyl)sulfamoyl]thiophene-2-carboxylate

Systemtic Name: 3-[1-adamantylmethyl(methyl)sulfamoyl]thiophene-2-carboxylate Openeye Name: 3-[1-adamantylmethyl(methyl)sulfamoyl]thiophene-2-carboxylate CAS Name: 3-[1-adamantylmethyl(methyl)sulfamoyl]-2-thiophenecarboxylate IUPAC Name: 3-[1-adamantylmethyl(methyl)sulfamoyl]thiophene-2-carboxylate Traditional Name: 3-[1-adamantylmethyl(methyl)sulfamoyl]-2-thenoate Formula: C17H22NO4S2- MolecularWeight: 368.49088

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC12CC3CC(C1)CC(C3)C2)S(=O)(=O)C4=C(SC=C4)C(=O)[O-]

Isomeric SMILES

CN(CC12CC3CC(C1)CC(C3)C2)S(=O)(=O)C4=C(SC=C4)C(=O)[O-]

InChI

InChI=1S/C17H23NO4S2/c1-18(24(21,22)14-2-3-23-15(14)16(19)20)10-17-7-11-4-12(8-17)6-13(5-11)9-17/h2-3,11-13H,4-10H2,1H3,(H,19,20)/p-1