4-(benzotriazol-2-yl)butane-1-sulfonic acid

Systemtic Name: 4-(benzotriazol-2-yl)butane-1-sulfonic acid Openeye Name: 4-(benzotriazol-2-yl)butane-1-sulfonic acid CAS Name: 4-(2-benzotriazolyl)-1-butanesulfonic acid IUPAC Name: 4-(benzotriazol-2-yl)butane-1-sulfonic acid Traditional Name: 4-(benzotriazol-2-yl)butane-1-sulfonic acid Formula: C10H13N3O3S MolecularWeight: 255.29352

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H13N3O3S/c14-17(15,16)8-4-3-7-13-11-9-5-1-2-6-10(9)12-13/h1-2,5-6H,3-4,7-8H2,(H,14,15,16)