N-(1-methylpyrazol-3-yl)-4-[(3-nitro-4-oxidanyl-phenyl)sulfonylamino]benzamide

Systemtic Name: N-(1-methylpyrazol-3-yl)-4-[(3-nitro-4-oxidanyl-phenyl)sulfonylamino]benzamide Openeye Name: 4-[(4-hydroxy-3-nitro-phenyl)sulfonylamino]-N-(1-methylpyrazol-3-yl)benzamide CAS Name: 4-[(4-hydroxy-3-nitrophenyl)sulfonylamino]-N-(1-methyl-3-pyrazolyl)benzamide IUPAC Name: 4-[(4-hydroxy-3-nitrophenyl)sulfonylamino]-N-(1-methylpyrazol-3-yl)benzamide Traditional Name: 4-[(4-hydroxy-3-nitro-phenyl)sulfonylamino]-N-(1-methylpyrazol-3-yl)benzamide Formula: C17H15N5O6S MolecularWeight: 417.3959

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC(=N1)NC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)O)[N+](=O)[O-]

Isomeric SMILES

CN1C=CC(=N1)NC(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC(=C(C=C3)O)[N+](=O)[O-]

InChI

InChI=1S/C17H15N5O6S/c1-21-9-8-16(19-21)18-17(24)11-2-4-12(5-3-11)20-29(27,28)13-6-7-15(23)14(10-13)22(25)26/h2-10,20,23H,1H3,(H,18,19,24)