5AO
Summary
Name: | 3-(1,3-oxazol-5-yl)aniline |
Formula: | C9 H8 N2 O |
Formal charge: | 0 |
Formula weight: | 160.173 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 3-(1,3-oxazol-5-yl)aniline |
OpenEye OEToolkits | 1.7.0 | 3-(1,3-oxazol-5-yl)aniline |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | n1cc(oc1)c2cc(ccc2)N |
SMILES_CANONICAL | CACTVS | 3.370 | Nc1cccc(c1)c2ocnc2 |
SMILES | CACTVS | 3.370 | Nc1cccc(c1)c2ocnc2 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1cc(cc(c1)N)c2cnco2 |
SMILES | OpenEye OEToolkits | 1.7.0 | c1cc(cc(c1)N)c2cnco2 |
InChI | InChI | 1.03 | InChI=1S/C9H8N2O/c10-8-3-1-2-7(4-8)9-5-11-6-12-9/h1-6H,10H2 |
InChIKey | InChI | 1.03 | AIELNJDAOGTASK-UHFFFAOYSA-N |