[5-azanyl-1-(4-fluorophenyl)sulfonyl-pyrazol-3-yl] 2-chloranyl-6-fluoranyl-benzoate

Systemtic Name: [5-azanyl-1-(4-fluorophenyl)sulfonyl-pyrazol-3-yl] 2-chloranyl-6-fluoranyl-benzoate Openeye Name: [5-amino-1-(4-fluorophenyl)sulfonyl-pyrazol-3-yl] 2-chloro-6-fluoro-benzoate CAS Name: 2-chloro-6-fluorobenzoic acid [5-amino-1-(4-fluorophenyl)sulfonyl-3-pyrazolyl] ester IUPAC Name: [5-amino-1-(4-fluorophenyl)sulfonylpyrazol-3-yl] 2-chloro-6-fluorobenzoate Traditional Name: 2-chloro-6-fluoro-benzoic acid [5-amino-1-(4-fluorophenyl)sulfonyl-pyrazol-3-yl] ester Formula: C16H10ClF2N3O4S MolecularWeight: 413.783106

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C(=C1)Cl)C(=O)OC2=NN(C(=C2)N)S(=O)(=O)C3=CC=C(C=C3)F)F

Isomeric SMILES

C1=CC(=C(C(=C1)Cl)C(=O)OC2=NN(C(=C2)N)S(=O)(=O)C3=CC=C(C=C3)F)F

InChI

InChI=1S/C16H10ClF2N3O4S/c17-11-2-1-3-12(19)15(11)16(23)26-14-8-13(20)22(21-14)27(24,25)10-6-4-9(18)5-7-10/h1-8H,20H2