2-chloranyl-N-[2-[3-(4-fluorophenyl)-6-oxidanylidene-pyridazin-1-yl]ethyl]-5-nitro-benzenesulfonamide

Systemtic Name: 2-chloranyl-N-[2-[3-(4-fluorophenyl)-6-oxidanylidene-pyridazin-1-yl]ethyl]-5-nitro-benzenesulfonamide Openeye Name: 2-chloro-N-[2-[3-(4-fluorophenyl)-6-oxo-pyridazin-1-yl]ethyl]-5-nitro-benzenesulfonamide CAS Name: 2-chloro-N-[2-[3-(4-fluorophenyl)-6-oxo-1-pyridazinyl]ethyl]-5-nitrobenzenesulfonamide IUPAC Name: 2-chloro-N-[2-[3-(4-fluorophenyl)-6-oxopyridazin-1-yl]ethyl]-5-nitrobenzenesulfonamide Traditional Name: 2-chloro-N-[2-[3-(4-fluorophenyl)-6-keto-pyridazin-1-yl]ethyl]-5-nitro-benzenesulfonamide Formula: C18H14ClFN4O5S MolecularWeight: 452.843963

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NN(C(=O)C=C2)CCNS(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)F

Isomeric SMILES

C1=CC(=CC=C1C2=NN(C(=O)C=C2)CCNS(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl)F

InChI

InChI=1S/C18H14ClFN4O5S/c19-15-6-5-14(24(26)27)11-17(15)30(28,29)21-9-10-23-18(25)8-7-16(22-23)12-1-3-13(20)4-2-12/h1-8,11,21H,9-10H2