[2-methoxy-4-[(E)-[(2-nitro-4-sulfamoyl-phenyl)hydrazinylidene]methyl]phenyl] pyridine-3-carboxylate

Systemtic Name: [2-methoxy-4-[(E)-[(2-nitro-4-sulfamoyl-phenyl)hydrazinylidene]methyl]phenyl] pyridine-3-carboxylate Openeye Name: [2-methoxy-4-[(E)-[(2-nitro-4-sulfamoyl-phenyl)hydrazono]methyl]phenyl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [2-methoxy-4-[(E)-[(2-nitro-4-sulfamoylphenyl)hydrazinylidene]methyl]phenyl] ester IUPAC Name: [2-methoxy-4-[(E)-[(2-nitro-4-sulfamoylphenyl)hydrazinylidene]methyl]phenyl] pyridine-3-carboxylate Traditional Name: nicotinic acid [2-methoxy-4-[(E)-[(2-nitro-4-sulfamoyl-phenyl)hydrazono]methyl]phenyl] ester Formula: C20H17N5O7S MolecularWeight: 471.44328

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=NNC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-])OC(=O)C3=CN=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)/C=N/NC2=C(C=C(C=C2)S(=O)(=O)N)[N+](=O)[O-])OC(=O)C3=CN=CC=C3

InChI

InChI=1S/C20H17N5O7S/c1-31-19-9-13(4-7-18(19)32-20(26)14-3-2-8-22-12-14)11-23-24-16-6-5-15(33(21,29)30)10-17(16)25(27)28/h2-12,24H,1H3,(H2,21,29,30)/b23-11+