2-[[[5-(diethylsulfamoyl)-2-methyl-phenyl]carbonylamino]methyl]-4-nitro-phenolate

Systemtic Name: 2-[[[5-(diethylsulfamoyl)-2-methyl-phenyl]carbonylamino]methyl]-4-nitro-phenolate Openeye Name: 2-[[[5-(diethylsulfamoyl)-2-methyl-benzoyl]amino]methyl]-4-nitro-phenolate CAS Name: 2-[[[[5-(diethylsulfamoyl)-2-methylphenyl]-oxomethyl]amino]methyl]-4-nitrophenolate IUPAC Name: 2-[[[5-(diethylsulfamoyl)-2-methylbenzoyl]amino]methyl]-4-nitrophenolate Traditional Name: 2-[[[5-(diethylsulfamoyl)-2-methyl-benzoyl]amino]methyl]-4-nitro-phenolate Formula: C19H22N3O6S- MolecularWeight: 420.45948

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)C(=O)NCC2=C(C=CC(=C2)[N+](=O)[O-])[O-]

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)C(=O)NCC2=C(C=CC(=C2)[N+](=O)[O-])[O-]

InChI

InChI=1S/C19H23N3O6S/c1-4-21(5-2)29(27,28)16-8-6-13(3)17(11-16)19(24)20-12-14-10-15(22(25)26)7-9-18(14)23/h6-11,23H,4-5,12H2,1-3H3,(H,20,24)/p-1