2-[[5-(dimethylsulfamoyl)-2-methyl-phenyl]iminomethyl]-4-nitro-phenolate

Systemtic Name: 2-[[5-(dimethylsulfamoyl)-2-methyl-phenyl]iminomethyl]-4-nitro-phenolate Openeye Name: 2-[[5-(dimethylsulfamoyl)-2-methyl-phenyl]iminomethyl]-4-nitro-phenolate CAS Name: 2-[[5-(dimethylsulfamoyl)-2-methylphenyl]iminomethyl]-4-nitrophenolate IUPAC Name: 2-[[5-(dimethylsulfamoyl)-2-methylphenyl]iminomethyl]-4-nitrophenolate Traditional Name: 2-[[5-(dimethylsulfamoyl)-2-methyl-phenyl]iminomethyl]-4-nitro-phenolate Formula: C16H16N3O5S- MolecularWeight: 362.38034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)N=CC2=C(C=CC(=C2)[N+](=O)[O-])[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)C)N=CC2=C(C=CC(=C2)[N+](=O)[O-])[O-]

InChI

InChI=1S/C16H17N3O5S/c1-11-4-6-14(25(23,24)18(2)3)9-15(11)17-10-12-8-13(19(21)22)5-7-16(12)20/h4-10,20H,1-3H3/p-1