ethyl 5-oxidanylidene-1-phenyl-4-[(4-sulfamoylphenyl)diazenyl]-4H-pyrazole-3-carboxylate

Systemtic Name: ethyl 5-oxidanylidene-1-phenyl-4-[(4-sulfamoylphenyl)diazenyl]-4H-pyrazole-3-carboxylate Openeye Name: ethyl 5-oxo-1-phenyl-4-(4-sulfamoylphenyl)azo-4H-pyrazole-3-carboxylate CAS Name: 5-oxo-1-phenyl-4-(4-sulfamoylphenyl)azo-4H-pyrazole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-oxo-1-phenyl-4-[(4-sulfamoylphenyl)diazenyl]-4H-pyrazole-3-carboxylate Traditional Name: 5-keto-1-phenyl-4-(4-sulfamoylphenyl)azo-2-pyrazoline-3-carboxylic acid ethyl ester Formula: C18H17N5O5S MolecularWeight: 415.42308

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C(=O)C1N=NC2=CC=C(C=C2)S(=O)(=O)N)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=NN(C(=O)C1N=NC2=CC=C(C=C2)S(=O)(=O)N)C3=CC=CC=C3

InChI

InChI=1S/C18H17N5O5S/c1-2-28-18(25)16-15(17(24)23(22-16)13-6-4-3-5-7-13)21-20-12-8-10-14(11-9-12)29(19,26)27/h3-11,15H,2H2,1H3,(H2,19,26,27)