HNO
Summary
Name: | N-tert-butyl-6,7-bis(chloranyl)quinoxalin-2-amine |
Formula: | C12 H13 Cl2 N3 |
Formal charge: | 0 |
Formula weight: | 270.158 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | ~{N}-~{tert}-butyl-6,7-bis(chloranyl)quinoxalin-2-amine |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C12H13Cl2N3/c1-12(2,3)17-11-6-15-9-4-7(13)8(14)5-10(9)16-11/h4-6H,1-3H3,(H,16,17) |
InChIKey | InChI | 1.03 | QYEPFRWKAAVUOP-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CC(C)(C)Nc1cnc2cc(Cl)c(Cl)cc2n1 |
SMILES | CACTVS | 3.385 | CC(C)(C)Nc1cnc2cc(Cl)c(Cl)cc2n1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(C)(C)Nc1cnc2cc(c(cc2n1)Cl)Cl |
SMILES | OpenEye OEToolkits | 2.0.7 | CC(C)(C)Nc1cnc2cc(c(cc2n1)Cl)Cl |