N-[3-[4-chloranyl-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-2-nitro-benzenesulfonamide

Systemtic Name: N-[3-[4-chloranyl-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-2-nitro-benzenesulfonamide Openeye Name: N-[3-[4-chloro-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-2-nitro-benzenesulfonamide CAS Name: N-[3-[4-chloro-5-methyl-3-(trifluoromethyl)-1-pyrazolyl]propyl]-2-nitrobenzenesulfonamide IUPAC Name: N-[3-[4-chloro-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-2-nitrobenzenesulfonamide Traditional Name: N-[3-[4-chloro-5-methyl-3-(trifluoromethyl)pyrazol-1-yl]propyl]-2-nitro-benzenesulfonamide Formula: C14H14ClF3N4O4S MolecularWeight: 426.79857

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CCCNS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])C(F)(F)F)Cl

Isomeric SMILES

CC1=C(C(=NN1CCCNS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-])C(F)(F)F)Cl

InChI

InChI=1S/C14H14ClF3N4O4S/c1-9-12(15)13(14(16,17)18)20-21(9)8-4-7-19-27(25,26)11-6-3-2-5-10(11)22(23)24/h2-3,5-6,19H,4,7-8H2,1H3