3-azanyl-4-butylsulfinyl-5-sulfamoyl-benzoic acid

Systemtic Name: 3-azanyl-4-butylsulfinyl-5-sulfamoyl-benzoic acid Openeye Name: 3-amino-4-butylsulfinyl-5-sulfamoyl-benzoic acid CAS Name: 3-amino-4-butylsulfinyl-5-sulfamoylbenzoic acid IUPAC Name: 3-amino-4-butylsulfinyl-5-sulfamoylbenzoic acid Traditional Name: 3-amino-4-butylsulfinyl-5-sulfamoyl-benzoic acid Formula: C11H16N2O5S2 MolecularWeight: 320.38514

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)C1=C(C=C(C=C1S(=O)(=O)N)C(=O)O)N

Isomeric SMILES

CCCCS(=O)C1=C(C=C(C=C1S(=O)(=O)N)C(=O)O)N

InChI

InChI=1S/C11H16N2O5S2/c1-2-3-4-19(16)10-8(12)5-7(11(14)15)6-9(10)20(13,17)18/h5-6H,2-4,12H2,1H3,(H,14,15)(H2,13,17,18)