XCX
2-(4-{2-[1,3-benzoxazol-2-yl(heptyl)amino]ethyl}phenoxy)-2-methylpropanoic acid
Find entries where: XCX
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
|---|---|
| Name | 2-(4-{2-[1,3-benzoxazol-2-yl(heptyl)amino]ethyl}phenoxy)-2-methylpropanoic acid |
| Identifiers | 2-[4-[2-[1,3-benzoxazol-2-yl(heptyl)amino]ethyl]phenoxy]-2-methyl-propanoic acid |
| Formula | C26 H34 N2 O4 |
| Molecular Weight | 438.559 |
| Type | NON-POLYMER |
| Isomeric SMILES | CCCCCCCN(CCc1ccc(cc1)OC(C)(C)C(=O)O)c2nc3ccccc3o2 |
| InChI | InChI=1S/C26H34N2O4/c1-4-5-6-7-10-18-28(25-27-22-11-8-9-12-23(22)31-25)19-17-20-13-15-21(16-14-20)32-26(2,3)24(29)30/h8-9,11-16H,4-7,10,17-19H2,1-3H3,(H,29,30) |
| InChIKey | MMVUCPZZXMPIPE-UHFFFAOYSA-N |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 66 |
| Chiral Atom Count | 0 |
| Bond Count | 68 |
| Aromatic Bond Count | 16 |
Related Resource References
| Resource Name | Reference |
|---|---|
| Pharos | CHEMBL477312 |
| PubChem | 18766436 |
| ChEMBL | CHEMBL477312 |
