72R
Summary
Name: | 5-fluoranyl-1~{H}-indole-2,3-dione |
Formula: | C8 H4 F N O2 |
Formal charge: | 0 |
Formula weight: | 165.121 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.5 | 5-fluoranyl-1~{H}-indole-2,3-dione |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C8H4FNO2/c9-4-1-2-6-5(3-4)7(11)8(12)10-6/h1-3H,(H,10,11,12) |
InChIKey | InChI | 1.03 | GKODDAXOSGGARJ-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Fc1ccc2NC(=O)C(=O)c2c1 |
SMILES | CACTVS | 3.385 | Fc1ccc2NC(=O)C(=O)c2c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.5 | c1cc2c(cc1F)C(=O)C(=O)N2 |
SMILES | OpenEye OEToolkits | 2.0.5 | c1cc2c(cc1F)C(=O)C(=O)N2 |