2-nitro-N-[4-(pyrazol-1-ylmethyl)phenyl]benzenesulfonamide

Systemtic Name: 2-nitro-N-[4-(pyrazol-1-ylmethyl)phenyl]benzenesulfonamide Openeye Name: 2-nitro-N-[4-(pyrazol-1-ylmethyl)phenyl]benzenesulfonamide CAS Name: 2-nitro-N-[4-(1-pyrazolylmethyl)phenyl]benzenesulfonamide IUPAC Name: 2-nitro-N-[4-(pyrazol-1-ylmethyl)phenyl]benzenesulfonamide Traditional Name: 2-nitro-N-[4-(pyrazol-1-ylmethyl)phenyl]benzenesulfonamide Formula: C16H14N4O4S MolecularWeight: 358.37176

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=C(C=C2)CN3C=CC=N3

Isomeric SMILES

C1=CC=C(C(=C1)[N+](=O)[O-])S(=O)(=O)NC2=CC=C(C=C2)CN3C=CC=N3

InChI

InChI=1S/C16H14N4O4S/c21-20(22)15-4-1-2-5-16(15)25(23,24)18-14-8-6-13(7-9-14)12-19-11-3-10-17-19/h1-11,18H,12H2