IDL
Summary
Name: | imidazo[1,2-a]pyridin-3-ylacetic acid |
Formula: | C9 H8 N2 O2 |
Formal charge: | 0 |
Formula weight: | 176.172 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | imidazo[1,2-a]pyridin-3-ylacetic acid |
OpenEye OEToolkits | 1.7.6 | 2-imidazo[1,2-a]pyridin-3-ylethanoic acid |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(O)Cc1cnc2ccccn12 |
InChI | InChI | 1.03 | InChI=1S/C9H8N2O2/c12-9(13)5-7-6-10-8-3-1-2-4-11(7)8/h1-4,6H,5H2,(H,12,13) |
InChIKey | InChI | 1.03 | ZVBVKRNOISRONE-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.370 | OC(=O)Cc1cnc2ccccn12 |
SMILES | CACTVS | 3.370 | OC(=O)Cc1cnc2ccccn12 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1ccn2c(c1)ncc2CC(=O)O |
SMILES | OpenEye OEToolkits | 1.7.6 | c1ccn2c(c1)ncc2CC(=O)O |