ZRK
Summary
Name: | 2-(4-PYRIDINYL)FURO[3,2-C]PYRIDIN-4(5H)-ONE |
Formula: | C12 H8 N2 O2 |
Formal charge: | 0 |
Formula weight: | 212.204 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 2-pyridin-4-ylfuro[3,2-c]pyridin-4(5H)-one |
OpenEye OEToolkits | 1.7.2 | 2-pyridin-4-yl-5H-furo[3,2-c]pyridin-4-one |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C2NC=Cc1oc(cc12)c3ccncc3 |
InChI | InChI | 1.03 | InChI=1S/C12H8N2O2/c15-12-9-7-11(8-1-4-13-5-2-8)16-10(9)3-6-14-12/h1-7H,(H,14,15) |
InChIKey | InChI | 1.03 | NLYCKXUGHPVKMO-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.370 | O=C1NC=Cc2oc(cc12)c3ccncc3 |
SMILES | CACTVS | 3.370 | O=C1NC=Cc2oc(cc12)c3ccncc3 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.2 | c1cnccc1c2cc3c(o2)C=CNC3=O |
SMILES | OpenEye OEToolkits | 1.7.2 | c1cnccc1c2cc3c(o2)C=CNC3=O |