7-[di(butan-2-yl)sulfamoyl]-9-oxidanylidene-fluorene-2-sulfonic acid

Systemtic Name: 7-[di(butan-2-yl)sulfamoyl]-9-oxidanylidene-fluorene-2-sulfonic acid Openeye Name: 7-(disec-butylsulfamoyl)-9-oxo-fluorene-2-sulfonic acid CAS Name: 7-[di(butan-2-yl)sulfamoyl]-9-oxo-2-fluorenesulfonic acid IUPAC Name: 7-[di(butan-2-yl)sulfamoyl]-9-oxofluorene-2-sulfonic acid Traditional Name: 7-(disec-butylsulfamoyl)-9-keto-fluorene-2-sulfonic acid Formula: C21H25NO6S2 MolecularWeight: 451.5563

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(C(C)CC)S(=O)(=O)C1=CC2=C(C=C1)C3=C(C2=O)C=C(C=C3)S(=O)(=O)O

Isomeric SMILES

CCC(C)N(C(C)CC)S(=O)(=O)C1=CC2=C(C=C1)C3=C(C2=O)C=C(C=C3)S(=O)(=O)O

InChI

InChI=1S/C21H25NO6S2/c1-5-13(3)22(14(4)6-2)29(24,25)15-7-9-17-18-10-8-16(30(26,27)28)12-20(18)21(23)19(17)11-15/h7-14H,5-6H2,1-4H3,(H,26,27,28)