(3-phenyl-1,2-oxazol-5-yl)methyl 2-bromanyl-5-(prop-2-enylsulfamoyl)benzoate

Systemtic Name: (3-phenyl-1,2-oxazol-5-yl)methyl 2-bromanyl-5-(prop-2-enylsulfamoyl)benzoate Openeye Name: (3-phenylisoxazol-5-yl)methyl 5-(allylsulfamoyl)-2-bromo-benzoate CAS Name: 2-bromo-5-(prop-2-enylsulfamoyl)benzoic acid (3-phenyl-5-isoxazolyl)methyl ester IUPAC Name: (3-phenyl-1,2-oxazol-5-yl)methyl 2-bromo-5-(prop-2-enylsulfamoyl)benzoate Traditional Name: 5-(allylsulfamoyl)-2-bromo-benzoic acid (3-phenylisoxazol-5-yl)methyl ester Formula: C20H17BrN2O5S MolecularWeight: 477.32838

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNS(=O)(=O)C1=CC(=C(C=C1)Br)C(=O)OCC2=CC(=NO2)C3=CC=CC=C3

Isomeric SMILES

C=CCNS(=O)(=O)C1=CC(=C(C=C1)Br)C(=O)OCC2=CC(=NO2)C3=CC=CC=C3

InChI

InChI=1S/C20H17BrN2O5S/c1-2-10-22-29(25,26)16-8-9-18(21)17(12-16)20(24)27-13-15-11-19(23-28-15)14-6-4-3-5-7-14/h2-9,11-12,22H,1,10,13H2