RIN
Summary
| Name: | 3-AMINO-AZACYCLOTRIDECAN-2-ONE |
| Formula: | C12 H24 N2 O |
| Formal charge: | 0 |
| Formula weight: | 212.332 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | (3S)-3-aminoazacyclotridecan-2-one |
| OpenEye OEToolkits | 1.5.0 | (3S)-3-amino-1-azacyclotridecan-2-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=C1NCCCCCCCCCCC1N |
| SMILES_CANONICAL | CACTVS | 3.341 | N[C@H]1CCCCCCCCCCNC1=O |
| SMILES | CACTVS | 3.341 | N[CH]1CCCCCCCCCCNC1=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C1CCCCCNC(=O)[C@H](CCCC1)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | C1CCCCCNC(=O)C(CCCC1)N |
| InChI | InChI | 1.03 | InChI=1S/C12H24N2O/c13-11-9-7-5-3-1-2-4-6-8-10-14-12(11)15/h11H,1-10,13H2,(H,14,15)/t11-/m0/s1 |
| InChIKey | InChI | 1.03 | CQZLEYBEPASILI-NSHDSACASA-N |
