2-nitro-N-[1-(phenylmethyl)pyrazol-4-yl]benzenesulfonamide

Systemtic Name: 2-nitro-N-[1-(phenylmethyl)pyrazol-4-yl]benzenesulfonamide Openeye Name: N-(1-benzylpyrazol-4-yl)-2-nitro-benzenesulfonamide CAS Name: 2-nitro-N-[1-(phenylmethyl)-4-pyrazolyl]benzenesulfonamide IUPAC Name: N-(1-benzylpyrazol-4-yl)-2-nitrobenzenesulfonamide Traditional Name: N-(1-benzylpyrazol-4-yl)-2-nitro-benzenesulfonamide Formula: C16H14N4O4S MolecularWeight: 358.37176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C=N2)NS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C=N2)NS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

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