2-[(2,3-dimethyl-5-sulfamoyl-phenyl)iminomethyl]-4-nitro-phenolate

Systemtic Name: 2-[(2,3-dimethyl-5-sulfamoyl-phenyl)iminomethyl]-4-nitro-phenolate Openeye Name: 2-[(2,3-dimethyl-5-sulfamoyl-phenyl)iminomethyl]-4-nitro-phenolate CAS Name: 2-[(2,3-dimethyl-5-sulfamoylphenyl)iminomethyl]-4-nitrophenolate IUPAC Name: 2-[(2,3-dimethyl-5-sulfamoylphenyl)iminomethyl]-4-nitrophenolate Traditional Name: 2-[(2,3-dimethyl-5-sulfamoyl-phenyl)iminomethyl]-4-nitro-phenolate Formula: C15H14N3O5S- MolecularWeight: 348.35376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)N=CC2=C(C=CC(=C2)[N+](=O)[O-])[O-])S(=O)(=O)N

Isomeric SMILES

CC1=CC(=CC(=C1C)N=CC2=C(C=CC(=C2)[N+](=O)[O-])[O-])S(=O)(=O)N

InChI

InChI=1S/C15H15N3O5S/c1-9-5-13(24(16,22)23)7-14(10(9)2)17-8-11-6-12(18(20)21)3-4-15(11)19/h3-8,19H,1-2H3,(H2,16,22,23)/p-1