BYD
Summary
Name: | N,N'-dihydroxybenzene-1,4-dicarboxamide |
Formula: | C8 H8 N2 O4 |
Formal charge: | 0 |
Formula weight: | 196.16 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | N,N'-dihydroxybenzene-1,4-dicarboxamide |
OpenEye OEToolkits | 1.9.2 | N1,N4-bis(oxidanyl)benzene-1,4-dicarboxamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | c1cc(ccc1C(NO)=O)C(NO)=O |
InChI | InChI | 1.03 | InChI=1S/C8H8N2O4/c11-7(9-13)5-1-2-6(4-3-5)8(12)10-14/h1-4,13-14H,(H,9,11)(H,10,12) |
InChIKey | InChI | 1.03 | YAJCYOUHZABXFT-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | ONC(=O)c1ccc(cc1)C(=O)NO |
SMILES | CACTVS | 3.385 | ONC(=O)c1ccc(cc1)C(=O)NO |
SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | c1cc(ccc1C(=O)NO)C(=O)NO |
SMILES | OpenEye OEToolkits | 1.9.2 | c1cc(ccc1C(=O)NO)C(=O)NO |