1N2
Summary
Name: | 1,1'-ethane-1,2-diyldipyrrolidine-2,5-dione |
Formula: | C10 H12 N2 O4 |
Formal charge: | 0 |
Formula weight: | 224.213 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | 1,1'-ethane-1,2-diyldipyrrolidine-2,5-dione |
OpenEye OEToolkits | 1.9.2 | 1-[2-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]ethyl]pyrrolidine-2,5-dione |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C1CCC(N1CCN2C(=O)CCC2=O)=O |
InChI | InChI | 1.03 | InChI=1S/C10H12N2O4/c13-7-1-2-8(14)11(7)5-6-12-9(15)3-4-10(12)16/h1-6H2 |
InChIKey | InChI | 1.03 | ZFMTZVFTWHQGNQ-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | O=C1CCC(=O)N1CCN2C(=O)CCC2=O |
SMILES | CACTVS | 3.385 | O=C1CCC(=O)N1CCN2C(=O)CCC2=O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | C1CC(=O)N(C1=O)CCN2C(=O)CCC2=O |
SMILES | OpenEye OEToolkits | 1.9.2 | C1CC(=O)N(C1=O)CCN2C(=O)CCC2=O |