C.I. Pigment Yellow 14
| Chemical identification | |
|---|---|
| CAS identifier | 5468-75-7 |
| Pubchem identifier | 93006 |
| DSSTox identifier | DTXSID9027601 |
| IUPAC name | 2-[[2-chloro-4-[3-chloro-4-[[1-(2-methylanilino)-1,3-dioxobutan-2-yl]diazenyl]phenyl]phenyl]diazenyl]-N-(2-methylphenyl)-3-oxobutanamide |
| Structure | 2D:2D MOL2D MOL22D SDF 3D:3D MOL3D MOL23D SDF3D PDB3D PDBQT |
| SMILES | CC(=O)C(C(=O)Nc1ccccc1C)/N=N/c1ccc(cc1Cl)c1ccc(c(c1)Cl)/N=N/C(C(=O)Nc1ccccc1C)C(=O)C |
| InChI | InChI=1S/C34H30Cl2N6O4/c1-19-9-5-7-11-27(19)37-33(45)31(21(3)43)41-39-29-15-13-23(17-25(29)35)24-14-16-30(26(36)18-24)40-42-32(22(4)44)34(46)38-28-12-8-6-10-20(28)2/h5-18,31-32H,1-4H3,(H,37,45)(H,38,46)/b41-39+,42-40+ |
| InChIKey | LQZFGPJGXVFSTR-LMXNTIJMSA-N |
| Chemical classification | |
|---|---|
| Kingdom | Organic compounds |
| Superclass | Benzenoids |
| Class | Benzene and substituted derivatives |
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