N-(5-methyl-1,2-oxazol-3-yl)-4-[(4-nitrophenyl)sulfonylamino]benzenesulfonamide

Systemtic Name: N-(5-methyl-1,2-oxazol-3-yl)-4-[(4-nitrophenyl)sulfonylamino]benzenesulfonamide Openeye Name: N-(5-methylisoxazol-3-yl)-4-[(4-nitrophenyl)sulfonylamino]benzenesulfonamide CAS Name: N-(5-methyl-3-isoxazolyl)-4-[(4-nitrophenyl)sulfonylamino]benzenesulfonamide IUPAC Name: N-(5-methyl-1,2-oxazol-3-yl)-4-[(4-nitrophenyl)sulfonylamino]benzenesulfonamide Traditional Name: N-(5-methylisoxazol-3-yl)-4-(nosylamino)benzenesulfonamide Formula: C16H14N4O7S2 MolecularWeight: 438.43496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H14N4O7S2/c1-11-10-16(17-27-11)19-29(25,26)14-6-2-12(3-7-14)18-28(23,24)15-8-4-13(5-9-15)20(21)22/h2-10,18H,1H3,(H,17,19)