DQE
Summary
| Name: | ethyl 5-pyridin-4-yl-1~{H}-indole-2-carboxylate |
| Formula: | C16 H14 N2 O2 |
| Formal charge: | 0 |
| Formula weight: | 266.295 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | ethyl 5-pyridin-4-yl-1~{H}-indole-2-carboxylate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C16H14N2O2/c1-2-20-16(19)15-10-13-9-12(3-4-14(13)18-15)11-5-7-17-8-6-11/h3-10,18H,2H2,1H3 |
| InChIKey | InChI | 1.06 | HESNUJSXTQZPIZ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCOC(=O)c1[nH]c2ccc(cc2c1)c3ccncc3 |
| SMILES | CACTVS | 3.385 | CCOC(=O)c1[nH]c2ccc(cc2c1)c3ccncc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCOC(=O)c1cc2cc(ccc2[nH]1)c3ccncc3 |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCOC(=O)c1cc2cc(ccc2[nH]1)c3ccncc3 |
