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

Systemtic Name: 2-[[2-chloranyl-3-(cyclohexylamino)-4,6-dinitro-phenyl]diazenyl]-N-(4-methoxyphenyl)ethanamide Openeye Name: 2-[2-chloro-3-(cyclohexylamino)-4,6-dinitro-phenyl]azo-N-(4-methoxyphenyl)acetamide CAS Name: 2-[2-chloro-3-(cyclohexylamino)-4,6-dinitrophenyl]azo-N-(4-methoxyphenyl)acetamide IUPAC Name: 2-[[2-chloro-3-(cyclohexylamino)-4,6-dinitrophenyl]diazenyl]-N-(4-methoxyphenyl)acetamide Traditional Name: 2-[2-chloro-3-(cyclohexylamino)-4,6-dinitro-phenyl]azo-N-(4-methoxyphenyl)acetamide Formula: C21H23ClN6O6 MolecularWeight: 490.89692

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C21H23ClN6O6/c1-34-15-9-7-14(8-10-15)24-18(29)12-23-26-21-17(28(32)33)11-16(27(30)31)20(19(21)22)25-13-5-3-2-4-6-13/h7-11,13,25H,2-6,12H2,1H3,(H,24,29)