N-(4-chlorophenyl)-2-(3-methyl-5-oxidanylidene-4H-pyrazol-1-yl)-5-nitro-benzenesulfonamide

Systemtic Name: N-(4-chlorophenyl)-2-(3-methyl-5-oxidanylidene-4H-pyrazol-1-yl)-5-nitro-benzenesulfonamide Openeye Name: N-(4-chlorophenyl)-2-(3-methyl-5-oxo-4H-pyrazol-1-yl)-5-nitro-benzenesulfonamide CAS Name: N-(4-chlorophenyl)-2-(3-methyl-5-oxo-4H-pyrazol-1-yl)-5-nitrobenzenesulfonamide IUPAC Name: N-(4-chlorophenyl)-2-(3-methyl-5-oxo-4H-pyrazol-1-yl)-5-nitrobenzenesulfonamide Traditional Name: N-(4-chlorophenyl)-2-(5-keto-3-methyl-2-pyrazolin-1-yl)-5-nitro-benzenesulfonamide Formula: C16H13ClN4O5S MolecularWeight: 408.81622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=O)C1)C2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=NN(C(=O)C1)C2=C(C=C(C=C2)[N+](=O)[O-])S(=O)(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H13ClN4O5S/c1-10-8-16(22)20(18-10)14-7-6-13(21(23)24)9-15(14)27(25,26)19-12-4-2-11(17)3-5-12/h2-7,9,19H,8H2,1H3