2-[(2,4-dimethylphenyl)diazenyl]-3-methylsulfonyl-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[(2,4-dimethylphenyl)diazenyl]-3-methylsulfonyl-5-nitro-benzenecarbonitrile Openeye Name: 2-(2,4-dimethylphenyl)azo-3-methylsulfonyl-5-nitro-benzonitrile CAS Name: 2-(2,4-dimethylphenyl)azo-3-methylsulfonyl-5-nitrobenzonitrile IUPAC Name: 2-[(2,4-dimethylphenyl)diazenyl]-3-methylsulfonyl-5-nitrobenzonitrile Traditional Name: 2-(2,4-dimethylphenyl)azo-3-mesyl-5-nitro-benzonitrile Formula: C16H14N4O4S MolecularWeight: 358.37176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N=NC2=C(C=C(C=C2C#N)[N+](=O)[O-])S(=O)(=O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N=NC2=C(C=C(C=C2C#N)[N+](=O)[O-])S(=O)(=O)C)C

InChI

InChI=1S/C16H14N4O4S/c1-10-4-5-14(11(2)6-10)18-19-16-12(9-17)7-13(20(21)22)8-15(16)25(3,23)24/h4-8H,1-3H3