3S1
6-[2-(hydroxymethyl)phenyl]isoquinolin-1(2H)-one
Find entries where: 3S1
is present as a standalone ligand in 1 entries
Chemical Component Summary | |
|---|---|
| Name | 6-[2-(hydroxymethyl)phenyl]isoquinolin-1(2H)-one |
| Identifiers | 6-[2-(hydroxymethyl)phenyl]-2H-isoquinolin-1-one |
| Formula | C16 H13 N O2 |
| Molecular Weight | 251.28 |
| Type | NON-POLYMER |
| Isomeric SMILES | c1ccc(c(c1)CO)c2ccc3c(c2)C=CNC3=O |
| InChI | InChI=1S/C16H13NO2/c18-10-13-3-1-2-4-14(13)11-5-6-15-12(9-11)7-8-17-16(15)19/h1-9,18H,10H2,(H,17,19) |
| InChIKey | UYPQNXCIONEUFC-UHFFFAOYSA-N |
Chemical Details | |
|---|---|
| Formal Charge | 0 |
| Atom Count | 32 |
| Chiral Atom Count | 0 |
| Bond Count | 34 |
| Aromatic Bond Count | 12 |
Related Resource References
| Resource Name | Reference |
|---|---|
| PubChem | 53393807 |
