6-[5-chloranyl-4-cyano-3-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonic acid

Systemtic Name: 6-[5-chloranyl-4-cyano-3-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonic acid Openeye Name: 6-[5-chloro-4-cyano-3-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonic acid CAS Name: 6-[5-chloro-4-cyano-3-(trifluoromethyl)-1-pyrazolyl]-3-pyridinesulfonic acid IUPAC Name: 6-[5-chloro-4-cyano-3-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonic acid Traditional Name: 6-[5-chloro-4-cyano-3-(trifluoromethyl)pyrazol-1-yl]pyridine-3-sulfonic acid Formula: C10H4ClF3N4O3S MolecularWeight: 352.67697

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC=C1S(=O)(=O)O)N2C(=C(C(=N2)C(F)(F)F)C#N)Cl

Isomeric SMILES

C1=CC(=NC=C1S(=O)(=O)O)N2C(=C(C(=N2)C(F)(F)F)C#N)Cl

InChI

InChI=1S/C10H4ClF3N4O3S/c11-9-6(3-15)8(10(12,13)14)17-18(9)7-2-1-5(4-16-7)22(19,20)21/h1-2,4H,(H,19,20,21)