4-bromanyl-2-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]iminomethyl]-6-nitro-phenolate

Systemtic Name: 4-bromanyl-2-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]iminomethyl]-6-nitro-phenolate Openeye Name: 4-bromo-2-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]iminomethyl]-6-nitro-phenolate CAS Name: 4-bromo-2-[[4-[(4,6-dimethyl-2-pyrimidinyl)sulfamoyl]phenyl]iminomethyl]-6-nitrophenolate IUPAC Name: 4-bromo-2-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]iminomethyl]-6-nitrophenolate Traditional Name: 4-bromo-2-[[4-[(4,6-dimethylpyrimidin-2-yl)sulfamoyl]phenyl]iminomethyl]-6-nitro-phenolate Formula: C19H15BrN5O5S- MolecularWeight: 505.3219

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N=CC3=CC(=CC(=C3[O-])[N+](=O)[O-])Br)C

Isomeric SMILES

CC1=CC(=NC(=N1)NS(=O)(=O)C2=CC=C(C=C2)N=CC3=CC(=CC(=C3[O-])[N+](=O)[O-])Br)C

InChI

InChI=1S/C19H16BrN5O5S/c1-11-7-12(2)23-19(22-11)24-31(29,30)16-5-3-15(4-6-16)21-10-13-8-14(20)9-17(18(13)26)25(27)28/h3-10,26H,1-2H3,(H,22,23,24)/p-1