4-[(3-oxidanylbenzotriazol-5-yl)sulfonylamino]benzoic acid

Systemtic Name: 4-[(3-oxidanylbenzotriazol-5-yl)sulfonylamino]benzoic acid Openeye Name: 4-[(3-hydroxybenzotriazol-5-yl)sulfonylamino]benzoic acid CAS Name: 4-[(3-hydroxy-5-benzotriazolyl)sulfonylamino]benzoic acid IUPAC Name: 4-[(3-hydroxybenzotriazol-5-yl)sulfonylamino]benzoic acid Traditional Name: 4-[(3-hydroxybenzotriazol-5-yl)sulfonylamino]benzoic acid Formula: C13H10N4O5S MolecularWeight: 334.3073

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)O)NS(=O)(=O)C2=CC3=C(C=C2)N=NN3O

Isomeric SMILES

C1=CC(=CC=C1C(=O)O)NS(=O)(=O)C2=CC3=C(C=C2)N=NN3O

InChI

InChI=1S/C13H10N4O5S/c18-13(19)8-1-3-9(4-2-8)15-23(21,22)10-5-6-11-12(7-10)17(20)16-14-11/h1-7,15,20H,(H,18,19)