36R
Summary
| Name: | 5-chloro-1,3-benzoxazol-2-amine |
| Formula: | C7 H5 Cl N2 O |
| Formal charge: | 0 |
| Formula weight: | 168.58 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 5-chloro-1,3-benzoxazol-2-amine |
| OpenEye OEToolkits | 1.7.6 | 5-chloranyl-1,3-benzoxazol-2-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Clc1cc2nc(oc2cc1)N |
| InChI | InChI | 1.03 | InChI=1S/C7H5ClN2O/c8-4-1-2-6-5(3-4)10-7(9)11-6/h1-3H,(H2,9,10) |
| InChIKey | InChI | 1.03 | YGCODSQDUUUKIV-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Nc1oc2ccc(Cl)cc2n1 |
| SMILES | CACTVS | 3.385 | Nc1oc2ccc(Cl)cc2n1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1cc2c(cc1Cl)nc(o2)N |
| SMILES | OpenEye OEToolkits | 1.7.6 | c1cc2c(cc1Cl)nc(o2)N |
