3-[(3-cyano-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl)diazenyl]-4-methoxy-benzenesulfonyl chloride

Systemtic Name: 3-[(3-cyano-5-oxidanylidene-1-phenyl-4H-pyrazol-4-yl)diazenyl]-4-methoxy-benzenesulfonyl chloride Openeye Name: 3-[(3-cyano-5-oxo-1-phenyl-4H-pyrazol-4-yl)azo]-4-methoxy-benzenesulfonyl chloride CAS Name: 3-[(3-cyano-5-oxo-1-phenyl-4H-pyrazol-4-yl)azo]-4-methoxybenzenesulfonyl chloride IUPAC Name: 3-[(3-cyano-5-oxo-1-phenyl-4H-pyrazol-4-yl)diazenyl]-4-methoxybenzenesulfonyl chloride Traditional Name: 3-[(3-cyano-5-keto-1-phenyl-2-pyrazolin-4-yl)azo]-4-methoxy-benzenesulfonyl chloride Formula: C17H12ClN5O4S MolecularWeight: 417.82628

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)Cl)N=NC2C(=NN(C2=O)C3=CC=CC=C3)C#N

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)Cl)N=NC2C(=NN(C2=O)C3=CC=CC=C3)C#N

InChI

InChI=1S/C17H12ClN5O4S/c1-27-15-8-7-12(28(18,25)26)9-13(15)20-21-16-14(10-19)22-23(17(16)24)11-5-3-2-4-6-11/h2-9,16H,1H3