GOR
Summary
| Name: | 6-nitronaphtho[1,2-e][1,3]benzodioxole-5-carboxylic acid |
| Formula: | C16 H9 N O6 |
| Formal charge: | 0 |
| Formula weight: | 311.246 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 6-nitronaphtho[1,2-e][1,3]benzodioxole-5-carboxylic acid |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C16H9NO6/c18-16(19)10-6-12-15(23-7-22-12)14-9-4-2-1-3-8(9)5-11(13(10)14)17(20)21/h1-6H,7H2,(H,18,19) |
| InChIKey | InChI | 1.03 | MEEXETVZNQYRSP-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OC(=O)c1cc2OCOc2c3c4ccccc4cc(c13)[N+]([O-])=O |
| SMILES | CACTVS | 3.385 | OC(=O)c1cc2OCOc2c3c4ccccc4cc(c13)[N+]([O-])=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)cc(c3c2c4c(cc3C(=O)O)OCO4)[N+](=O)[O-] |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)cc(c3c2c4c(cc3C(=O)O)OCO4)[N+](=O)[O-] |
