4-[3-(hydroxymethyl)-5-(4-nitrophenyl)pyrazol-1-yl]benzenesulfonamide

Systemtic Name: 4-[3-(hydroxymethyl)-5-(4-nitrophenyl)pyrazol-1-yl]benzenesulfonamide Openeye Name: 4-[3-(hydroxymethyl)-5-(4-nitrophenyl)pyrazol-1-yl]benzenesulfonamide CAS Name: 4-[3-(hydroxymethyl)-5-(4-nitrophenyl)-1-pyrazolyl]benzenesulfonamide IUPAC Name: 4-[3-(hydroxymethyl)-5-(4-nitrophenyl)pyrazol-1-yl]benzenesulfonamide Traditional Name: 4-[3-methylol-5-(4-nitrophenyl)pyrazol-1-yl]benzenesulfonamide Formula: C16H14N4O5S MolecularWeight: 374.37116

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)CO)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)CO)[N+](=O)[O-]

InChI

InChI=1S/C16H14N4O5S/c17-26(24,25)15-7-5-13(6-8-15)19-16(9-12(10-21)18-19)11-1-3-14(4-2-11)20(22)23/h1-9,21H,10H2,(H2,17,24,25)