Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Methanol | HCID 887 | — |
| Reactant | Sodium ion | HCID 923 | — |
| Reactant | 1,2-Dimethoxyethane | HCID 8071 | — |
| Reactant | Ethyl Acetate | HCID 8857 | — |
| Reactant | Carbonate Ion | HCID 19660 | — |
| Reactant | tert-Butyl carbamate | HCID 77922 | — |
| Reactant | Phenylboronic acid 1,3-propanediol ester | HCID 642685 | — |
| Reactant | HCID 58816122 | HCID 58816122 | — |
| Product | tert-Butyl carbamate | HCID 77922 | — |
| Product | 7-Phenyl-isoquinoline-5-sulfonic acid (2-amino-ethyl)-amide | HCID 11290356 | — |
Provenance & Evidence
| DOI | 10.1039/C8SC04228D |
|---|
| Source dataset | Training data from https://doi.org/10.1039/C8SC04228D (9/10) |
|---|
| ORD ID | ord-b3fcd5c2a290470db508f847b21feba3 |
|---|
| Source note | Training data from https://doi.org/10.1039/C8SC04228D (9/10) |
|---|
