YFJ
Summary
| Name: | 8-pyridin-4-yl-2,3,4,9-tetrahydropyrido[3,4-b]indol-1-one |
| Formula: | C16 H13 N3 O |
| Formal charge: | 0 |
| Formula weight: | 263.294 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 8-pyridin-4-yl-2,3,4,9-tetrahydropyrido[3,4-b]indol-1-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C16H13N3O/c20-16-15-13(6-9-18-16)12-3-1-2-11(14(12)19-15)10-4-7-17-8-5-10/h1-5,7-8,19H,6,9H2,(H,18,20) |
| InChIKey | InChI | 1.06 | SLQNWICAFNPZCB-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C1NCCc2c1[nH]c3c2cccc3c4ccncc4 |
| SMILES | CACTVS | 3.385 | O=C1NCCc2c1[nH]c3c2cccc3c4ccncc4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc2c3c([nH]c2c(c1)c4ccncc4)C(=O)NCC3 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc2c3c([nH]c2c(c1)c4ccncc4)C(=O)NCC3 |
