N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]-3-nitro-benzenesulfonamide

Systemtic Name: N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]-3-nitro-benzenesulfonamide Openeye Name: N-[4-[(5-methylisoxazol-3-yl)sulfamoyl]phenyl]-3-nitro-benzenesulfonamide CAS Name: N-[4-[(5-methyl-3-isoxazolyl)sulfamoyl]phenyl]-3-nitrobenzenesulfonamide IUPAC Name: N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]-3-nitrobenzenesulfonamide Traditional Name: N-[4-[(5-methylisoxazol-3-yl)sulfamoyl]phenyl]-3-nitro-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=CC(=C3)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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