JS1
ethyl 4-[(dimethylamino)methyl]-5-hydroxy-2-phenyl-1-benzofuran-3-carboxylate
Find entries where: JS1
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
|---|---|
| Name | ethyl 4-[(dimethylamino)methyl]-5-hydroxy-2-phenyl-1-benzofuran-3-carboxylate |
| Identifiers | ethyl 4-[(dimethylamino)methyl]-5-oxidanyl-2-phenyl-1-benzofuran-3-carboxylate |
| Formula | C20 H21 N O4 |
| Molecular Weight | 339.385 |
| Type | NON-POLYMER |
| Isomeric SMILES | CCOC(=O)c1c2c(ccc(c2CN(C)C)O)oc1c3ccccc3 |
| InChI | InChI=1S/C20H21NO4/c1-4-24-20(23)18-17-14(12-21(2)3)15(22)10-11-16(17)25-19(18)13-8-6-5-7-9-13/h5-11,22H,4,12H2,1-3H3 |
| InChIKey | JXUHSUSCLWIKEW-UHFFFAOYSA-N |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 46 |
| Chiral Atom Count | 0 |
| Bond Count | 48 |
| Aromatic Bond Count | 16 |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 40122, 44666783 |
| ChEMBL | CHEMBL1327799 |
