LL1
Summary
Name: | 3-pyridin-4-yl-1H-indazole |
Formula: | C12 H9 N3 |
Formal charge: | 0 |
Formula weight: | 195.22 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 10.04 | 3-pyridin-4-yl-1H-indazole |
OpenEye OEToolkits | 1.5.0 | 3-pyridin-4-yl-1H-indazole |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | n2c(c1ccccc1n2)c3ccncc3 |
SMILES_CANONICAL | CACTVS | 3.341 | [nH]1nc(c2ccncc2)c3ccccc13 |
SMILES | CACTVS | 3.341 | [nH]1nc(c2ccncc2)c3ccccc13 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1ccc2c(c1)c(n[nH]2)c3ccncc3 |
SMILES | OpenEye OEToolkits | 1.5.0 | c1ccc2c(c1)c(n[nH]2)c3ccncc3 |
InChI | InChI | 1.03 | InChI=1S/C12H9N3/c1-2-4-11-10(3-1)12(15-14-11)9-5-7-13-8-6-9/h1-8H,(H,14,15) |
InChIKey | InChI | 1.03 | MSRXUUDVRNWSTN-UHFFFAOYSA-N |