3-chloranyl-N-(1-ethylpyrazol-4-yl)-4-methyl-5-nitro-benzenesulfonamide

Systemtic Name: 3-chloranyl-N-(1-ethylpyrazol-4-yl)-4-methyl-5-nitro-benzenesulfonamide Openeye Name: 3-chloro-N-(1-ethylpyrazol-4-yl)-4-methyl-5-nitro-benzenesulfonamide CAS Name: 3-chloro-N-(1-ethyl-4-pyrazolyl)-4-methyl-5-nitrobenzenesulfonamide IUPAC Name: 3-chloro-N-(1-ethylpyrazol-4-yl)-4-methyl-5-nitrobenzenesulfonamide Traditional Name: 3-chloro-N-(1-ethylpyrazol-4-yl)-4-methyl-5-nitro-benzenesulfonamide Formula: C12H13ClN4O4S MolecularWeight: 344.77402

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)NS(=O)(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])C)Cl

Isomeric SMILES

CCN1C=C(C=N1)NS(=O)(=O)C2=CC(=C(C(=C2)[N+](=O)[O-])C)Cl

InChI

InChI=1S/C12H13ClN4O4S/c1-3-16-7-9(6-14-16)15-22(20,21)10-4-11(13)8(2)12(5-10)17(18)19/h4-7,15H,3H2,1-2H3