A1CW7
Summary
| Name: | 5,6,7,8-tetrahydro-4H-furo[3,2-c]azepin-4-one |
| Formula: | C8 H9 N O2 |
| Formal charge: | 0 |
| Formula weight: | 151.163 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | 5,6,7,8-tetrahydro-4H-furo[3,2-c]azepin-4-one |
| OpenEye OEToolkits | 3.1.0.0 | 5,6,7,8-tetrahydrofuro[3,2-c]azepin-4-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=C1NCCCc2occc12 |
| InChI | InChI | 1.06 | InChI=1S/C8H9NO2/c10-8-6-3-5-11-7(6)2-1-4-9-8/h3,5H,1-2,4H2,(H,9,10) |
| InChIKey | InChI | 1.06 | FZCXAFBKFNEFCQ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C1NCCCc2occc12 |
| SMILES | CACTVS | 3.385 | O=C1NCCCc2occc12 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | c1coc2c1C(=O)NCCC2 |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | c1coc2c1C(=O)NCCC2 |
