3-(3-imidazol-1-ylpropylsulfamoyl)benzoate

Systemtic Name: 3-(3-imidazol-1-ylpropylsulfamoyl)benzoate Openeye Name: 3-(3-imidazol-1-ylpropylsulfamoyl)benzoate CAS Name: 3-[3-(1-imidazolyl)propylsulfamoyl]benzoate IUPAC Name: 3-(3-imidazol-1-ylpropylsulfamoyl)benzoate Traditional Name: 3-(3-imidazol-1-ylpropylsulfamoyl)benzoate Formula: C13H14N3O4S- MolecularWeight: 308.33296

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)NCCCN2C=CN=C2)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)NCCCN2C=CN=C2)C(=O)[O-]

InChI

InChI=1S/C13H15N3O4S/c17-13(18)11-3-1-4-12(9-11)21(19,20)15-5-2-7-16-8-6-14-10-16/h1,3-4,6,8-10,15H,2,5,7H2,(H,17,18)/p-1