2-(benzotriazol-2-yl)ethanesulfonic acid

Systemtic Name: 2-(benzotriazol-2-yl)ethanesulfonic acid Openeye Name: 2-(benzotriazol-2-yl)ethanesulfonic acid CAS Name: 2-(2-benzotriazolyl)ethanesulfonic acid IUPAC Name: 2-(benzotriazol-2-yl)ethanesulfonic acid Traditional Name: 2-(benzotriazol-2-yl)ethanesulfonic acid Formula: C8H9N3O3S MolecularWeight: 227.24036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NN(N=C2C=C1)CCS(=O)(=O)O

Isomeric SMILES

C1=CC2=NN(N=C2C=C1)CCS(=O)(=O)O

InChI

InChI=1S/C8H9N3O3S/c12-15(13,14)6-5-11-9-7-3-1-2-4-8(7)10-11/h1-4H,5-6H2,(H,12,13,14)