V9Y
Summary
Name: | N~2~,N~5~-dihydroxyfuran-2,5-dicarboxamide |
Formula: | C6 H6 N2 O5 |
Formal charge: | 0 |
Formula weight: | 186.122 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | N~2~,N~5~-dihydroxyfuran-2,5-dicarboxamide |
OpenEye OEToolkits | 2.0.7 | ~{N}2,~{N}5-bis(oxidanyl)furan-2,5-dicarboxamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | C(=O)(NO)c1ccc(o1)C(=O)NO |
InChI | InChI | 1.03 | InChI=1S/C6H6N2O5/c9-5(7-11)3-1-2-4(13-3)6(10)8-12/h1-2,11-12H,(H,7,9)(H,8,10) |
InChIKey | InChI | 1.03 | PJWJTAUUGOFUIE-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | ONC(=O)c1oc(cc1)C(=O)NO |
SMILES | CACTVS | 3.385 | ONC(=O)c1oc(cc1)C(=O)NO |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(oc1C(=O)NO)C(=O)NO |
SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(oc1C(=O)NO)C(=O)NO |