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

Systemtic Name: 4-chloranyl-N-[[1-methyl-5-phenoxy-3-(trifluoromethyl)pyrazol-4-yl]methyl]-3-nitro-benzenesulfonamide Openeye Name: 4-chloro-N-[[1-methyl-5-phenoxy-3-(trifluoromethyl)pyrazol-4-yl]methyl]-3-nitro-benzenesulfonamide CAS Name: 4-chloro-N-[[1-methyl-5-phenoxy-3-(trifluoromethyl)-4-pyrazolyl]methyl]-3-nitrobenzenesulfonamide IUPAC Name: 4-chloro-N-[[1-methyl-5-phenoxy-3-(trifluoromethyl)pyrazol-4-yl]methyl]-3-nitrobenzenesulfonamide Traditional Name: 4-chloro-N-[[1-methyl-5-phenoxy-3-(trifluoromethyl)pyrazol-4-yl]methyl]-3-nitro-benzenesulfonamide Formula: C18H14ClF3N4O5S MolecularWeight: 490.84077

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C(F)(F)F)CNS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])OC3=CC=CC=C3

Isomeric SMILES

CN1C(=C(C(=N1)C(F)(F)F)CNS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-])OC3=CC=CC=C3

InChI

InChI=1S/C18H14ClF3N4O5S/c1-25-17(31-11-5-3-2-4-6-11)13(16(24-25)18(20,21)22)10-23-32(29,30)12-7-8-14(19)15(9-12)26(27)28/h2-9,23H,10H2,1H3