A1A4G
Summary
| Name: | 1-[4-(2-phenylhydrazin-1-yl)phenyl]pyrrolidine-2,5-dione |
| Formula: | C16 H15 N3 O2 |
| Formal charge: | 0 |
| Formula weight: | 281.309 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | 1-[4-(2-phenylhydrazin-1-yl)phenyl]pyrrolidine-2,5-dione |
| OpenEye OEToolkits | 2.0.7 | 1-[4-(2-phenylhydrazinyl)phenyl]pyrrolidine-2,5-dione |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=C1CCC(=O)N1c1ccc(NNc2ccccc2)cc1 |
| InChI | InChI | 1.06 | InChI=1S/C16H15N3O2/c20-15-10-11-16(21)19(15)14-8-6-13(7-9-14)18-17-12-4-2-1-3-5-12/h1-9,17-18H,10-11H2 |
| InChIKey | InChI | 1.06 | XQZVOVPQWDSFBG-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C1CCC(=O)N1c2ccc(NNc3ccccc3)cc2 |
| SMILES | CACTVS | 3.385 | O=C1CCC(=O)N1c2ccc(NNc3ccccc3)cc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)NNc2ccc(cc2)N3C(=O)CCC3=O |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)NNc2ccc(cc2)N3C(=O)CCC3=O |
