4-chloranyl-N-(1-methylpyrazol-3-yl)-3-nitro-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-(1-methylpyrazol-3-yl)-3-nitro-benzenesulfonamide Openeye Name: 4-chloro-N-(1-methylpyrazol-3-yl)-3-nitro-benzenesulfonamide CAS Name: 4-chloro-N-(1-methyl-3-pyrazolyl)-3-nitrobenzenesulfonamide IUPAC Name: 4-chloro-N-(1-methylpyrazol-3-yl)-3-nitrobenzenesulfonamide Traditional Name: 4-chloro-N-(1-methylpyrazol-3-yl)-3-nitro-benzenesulfonamide Formula: C10H9ClN4O4S MolecularWeight: 316.72086

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CN1C=CC(=N1)NS(=O)(=O)C2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C10H9ClN4O4S/c1-14-5-4-10(12-14)13-20(18,19)7-2-3-8(11)9(6-7)15(16)17/h2-6H,1H3,(H,12,13)