5-methyl-2H-benzotriazole-4-sulfonic acid

Systemtic Name: 5-methyl-2H-benzotriazole-4-sulfonic acid Openeye Name: 5-methyl-2H-benzotriazole-4-sulfonic acid CAS Name: 5-methyl-2H-benzotriazole-4-sulfonic acid IUPAC Name: 5-methyl-2H-benzotriazole-4-sulfonic acid Traditional Name: 5-methyl-2H-benzotriazole-4-sulfonic acid Formula: C7H7N3O3S MolecularWeight: 213.21378

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=NNN=C2C=C1)S(=O)(=O)O

Isomeric SMILES

CC1=C(C2=NNN=C2C=C1)S(=O)(=O)O

InChI

InChI=1S/C7H7N3O3S/c1-4-2-3-5-6(9-10-8-5)7(4)14(11,12)13/h2-3H,1H3,(H,8,9,10)(H,11,12,13)