2-[[2-cyano-3-(cyclohexylamino)-4,6-dinitro-phenyl]diazenyl]-N-(4-methoxyphenyl)ethanamide

Systemtic Name: 2-[[2-cyano-3-(cyclohexylamino)-4,6-dinitro-phenyl]diazenyl]-N-(4-methoxyphenyl)ethanamide Openeye Name: 2-[2-cyano-3-(cyclohexylamino)-4,6-dinitro-phenyl]azo-N-(4-methoxyphenyl)acetamide CAS Name: 2-[2-cyano-3-(cyclohexylamino)-4,6-dinitrophenyl]azo-N-(4-methoxyphenyl)acetamide IUPAC Name: 2-[[2-cyano-3-(cyclohexylamino)-4,6-dinitrophenyl]diazenyl]-N-(4-methoxyphenyl)acetamide Traditional Name: 2-[2-cyano-3-(cyclohexylamino)-4,6-dinitro-phenyl]azo-N-(4-methoxyphenyl)acetamide Formula: C22H23N7O6 MolecularWeight: 481.46132

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)CN=NC2=C(C(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])NC3CCCCC3)C#N

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)CN=NC2=C(C(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])NC3CCCCC3)C#N

InChI

InChI=1S/C22H23N7O6/c1-35-16-9-7-15(8-10-16)25-20(30)13-24-27-22-17(12-23)21(26-14-5-3-2-4-6-14)18(28(31)32)11-19(22)29(33)34/h7-11,14,26H,2-6,13H2,1H3,(H,25,30)