SQ4
Summary
Name: | 1-(4-aminophenyl)pyrrole-2,5-dione |
Formula: | C10 H8 N2 O2 |
Formal charge: | 0 |
Formula weight: | 188.183 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | 1-(4-aminophenyl)pyrrole-2,5-dione |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C10H8N2O2/c11-7-1-3-8(4-2-7)12-9(13)5-6-10(12)14/h1-6H,11H2 |
InChIKey | InChI | 1.03 | XOPCHXSYQHXLHJ-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Nc1ccc(cc1)N2C(=O)C=CC2=O |
SMILES | CACTVS | 3.385 | Nc1ccc(cc1)N2C(=O)C=CC2=O |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc(ccc1N)N2C(=O)C=CC2=O |
SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(ccc1N)N2C(=O)C=CC2=O |