G9D
Summary
| Name: | 3-(morpholin-4-ylmethyl)-1,5-dihydro-6H-[1,2]diazepino[4,5,6-cd]indol-6-one |
| Formula: | C15 H16 N4 O2 |
| Formal charge: | 0 |
| Formula weight: | 284.313 Da |
| Component type: | NON-POLYMER |
| Ambiguous Chemistry Warning: | The chemical description of this component is not well described in this definition. Descriptors and chemical names should be used with caution. |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES_CANONICAL | CACTVS | 3.352 | O=C1NN=C(CN2CCOCC2)c3c[nH]c4cccc1c34 |
| SMILES | CACTVS | 3.352 | O=C1NN=C(CN2CCOCC2)c3c[nH]c4cccc1c34 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1cc2c3c(c1)[nH]cc3C(=NNC2=O)CN4CCOCC4 |
| SMILES | OpenEye OEToolkits | 1.7.0 | c1cc2c3c(c1)[nH]cc3C(=NNC2=O)CN4CCOCC4 |
| InChI | InChI | 1.03 | InChI=1S/C15H16N4O2/c20-15-10-2-1-3-12-14(10)11(8-16-12)13(17-18-15)9-19-4-6-21-7-5-19/h1-3,8,16H,4-7,9H2,(H,18,20) |
| InChIKey | InChI | 1.03 | VLZMFVRHOYPDFA-UHFFFAOYSA-N |
