JX8
Summary
| Name: | 5-(1~{H}-1,2,3,4-tetrazol-5-yl)quinolin-8-ol |
| Formula: | C10 H7 N5 O |
| Formal charge: | 0 |
| Formula weight: | 213.195 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 5-(1~{H}-1,2,3,4-tetrazol-5-yl)quinolin-8-ol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C10H7N5O/c16-8-4-3-7(10-12-14-15-13-10)6-2-1-5-11-9(6)8/h1-5,16H,(H,12,13,14,15) |
| InChIKey | InChI | 1.03 | COSOIVLLWHGBPW-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Oc1ccc(c2[nH]nnn2)c3cccnc13 |
| SMILES | CACTVS | 3.385 | Oc1ccc(c2[nH]nnn2)c3cccnc13 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc2c(ccc(c2nc1)O)c3[nH]nnn3 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc2c(ccc(c2nc1)O)c3[nH]nnn3 |
