67Y
2-hydroxy-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide
| Created: | 2016-02-16 |
| Last modified: | 2016-03-23 |
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Chemical Details | |
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| Formal Charge | 0 |
| Atom Count | 30 |
| Chiral Atom Count | 1 |
| Bond Count | 31 |
| Aromatic Bond Count | 6 |
Chemical Component Summary | |
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| Name | 2-hydroxy-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]acetamide |
| Systematic Name (OpenEye OEToolkits) | 2-oxidanyl-~{N}-[(1~{R})-1,2,3,4-tetrahydronaphthalen-1-yl]ethanamide |
| Formula | C12 H15 N O2 |
| Molecular Weight | 205.253 |
| Type | NON-POLYMER |
Chemical Descriptors | |||
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| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | C2(c1c(cccc1)CCC2)NC(CO)=O |
| SMILES | CACTVS | 3.385 | OCC(=O)N[CH]1CCCc2ccccc12 |
| SMILES | OpenEye OEToolkits | 2.0.4 | c1ccc2c(c1)CCCC2NC(=O)CO |
| Canonical SMILES | CACTVS | 3.385 | OCC(=O)N[C@@H]1CCCc2ccccc12 |
| Canonical SMILES | OpenEye OEToolkits | 2.0.4 | c1ccc2c(c1)CCC[C@H]2NC(=O)CO |
| InChI | InChI | 1.03 | InChI=1S/C12H15NO2/c14-8-12(15)13-11-7-3-5-9-4-1-2-6-10(9)11/h1-2,4,6,11,14H,3,5,7-8H2,(H,13,15)/t11-/m1/s1 |
| InChIKey | InChI | 1.03 | BBTOVZWCAMQWRJ-LLVKDONJSA-N |
Related Resource References
| Resource Name | Reference |
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| PubChem | 29892811 |














