3F8
Summary
| Name: | 1,1'-[ethane-1,2-diylbis(oxyethane-2,1-diyl)]bis(1H-pyrrole-2,5-dione) |
| Formula: | C14 H16 N2 O6 |
| Formal charge: | 0 |
| Formula weight: | 308.287 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1,1'-[ethane-1,2-diylbis(oxyethane-2,1-diyl)]bis(1H-pyrrole-2,5-dione) |
| OpenEye OEToolkits | 1.9.2 | 1-[2-[2-[2-[2,5-bis(oxidanylidene)pyrrol-1-yl]ethoxy]ethoxy]ethyl]pyrrole-2,5-dione |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C1C=CC(=O)N1CCOCCOCCN2C(=O)C=CC2=O |
| InChI | InChI | 1.03 | InChI=1S/C14H16N2O6/c17-11-1-2-12(18)15(11)5-7-21-9-10-22-8-6-16-13(19)3-4-14(16)20/h1-4H,5-10H2 |
| InChIKey | InChI | 1.03 | FERLGYOHRKHQJP-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C1C=CC(=O)N1CCOCCOCCN2C(=O)C=CC2=O |
| SMILES | CACTVS | 3.385 | O=C1C=CC(=O)N1CCOCCOCCN2C(=O)C=CC2=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | C1=CC(=O)N(C1=O)CCOCCOCCN2C(=O)C=CC2=O |
| SMILES | OpenEye OEToolkits | 1.9.2 | C1=CC(=O)N(C1=O)CCOCCOCCN2C(=O)C=CC2=O |
