3-chloranyl-2,6-dimethyl-2H-1,3,5-triazine-4-sulfonic acid

Systemtic Name: 3-chloranyl-2,6-dimethyl-2H-1,3,5-triazine-4-sulfonic acid Openeye Name: 3-chloro-2,6-dimethyl-2H-1,3,5-triazine-4-sulfonic acid CAS Name: 3-chloro-2,6-dimethyl-2H-1,3,5-triazine-4-sulfonic acid IUPAC Name: 3-chloro-2,6-dimethyl-2H-1,3,5-triazine-4-sulfonic acid Traditional Name: 3-chloro-2,6-dimethyl-2H-s-triazine-4-sulfonic acid Formula: C5H8ClN3O3S MolecularWeight: 225.65332

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Descriptors Computed from Structure

Canonical SMILES:

CC1N=C(N=C(N1Cl)S(=O)(=O)O)C

Isomeric SMILES

CC1N=C(N=C(N1Cl)S(=O)(=O)O)C

InChI

InChI=1S/C5H8ClN3O3S/c1-3-7-4(2)9(6)5(8-3)13(10,11)12/h4H,1-2H3,(H,10,11,12)