N-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]pyrazol-3-yl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[1-[(2-chloranyl-4-fluoranyl-phenyl)methyl]pyrazol-3-yl]-3-nitro-benzenesulfonamide Openeye Name: N-[1-[(2-chloro-4-fluoro-phenyl)methyl]pyrazol-3-yl]-3-nitro-benzenesulfonamide CAS Name: N-[1-[(2-chloro-4-fluorophenyl)methyl]-3-pyrazolyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[1-[(2-chloro-4-fluorophenyl)methyl]pyrazol-3-yl]-3-nitrobenzenesulfonamide Traditional Name: N-[1-(2-chloro-4-fluoro-benzyl)pyrazol-3-yl]-3-nitro-benzenesulfonamide Formula: C16H12ClFN4O4S MolecularWeight: 410.807283

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)S(=O)(=O)NC2=NN(C=C2)CC3=C(C=C(C=C3)F)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)S(=O)(=O)NC2=NN(C=C2)CC3=C(C=C(C=C3)F)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H12ClFN4O4S/c17-15-8-12(18)5-4-11(15)10-21-7-6-16(19-21)20-27(25,26)14-3-1-2-13(9-14)22(23)24/h1-9H,10H2,(H,19,20)