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CHEBI:106043 - 4-[4-(3-methyl-4-nitrophenoxy)butoxy]benzonitrile
| Formula | C18H18N2O4 |
| Net Charge | 0 |
| Average Mass | 326.352 |
| Monoisotopic Mass | 326.12666 |
| SMILES | Cc1cc(OCCCCOc2ccc(C#N)cc2)ccc1[N+](=O)[O-] |
| InChI | InChI=1S/C18H18N2O4/c1-14-12-17(8-9-18(14)20(21)22)24-11-3-2-10-23-16-6-4-15(13-19)5-7-16/h4-9,12H,2-3,10-11H2,1H3 |
| InChIKey | YAARDHUAQHWZFX-UHFFFAOYSA-N |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| 4-[4-(3-methyl-4-nitrophenoxy)butoxy]benzonitrile (CHEBI:106043) is a C-nitro compound (CHEBI:35716) |
| 4-[4-(3-methyl-4-nitrophenoxy)butoxy]benzonitrile (CHEBI:106043) is a aromatic ether (CHEBI:35618) |
| Manual Xrefs | Databases |
|---|---|
| LSM-17404 | LINCS |