MT8
Summary
| Name: | (1R)-1-hydroxy-1-methyl-2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-5-one |
| Formula: | C13 H15 N O2 |
| Formal charge: | 0 |
| Formula weight: | 217.264 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (1R)-1-hydroxy-1-methyl-2,3,6,7-tetrahydro-1H,5H-pyrido[3,2,1-ij]quinolin-5-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C3N2c1c(cccc1C(O)(CC2)C)CC3 |
| InChI | InChI | 1.03 | InChI=1S/C13H15NO2/c1-13(16)7-8-14-11(15)6-5-9-3-2-4-10(13)12(9)14/h2-4,16H,5-8H2,1H3/t13-/m1/s1 |
| InChIKey | InChI | 1.03 | FHMNDLFMEHZYLO-CYBMUJFWSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | C[C@@]1(O)CCN2C(=O)CCc3cccc1c23 |
| SMILES | CACTVS | 3.370 | C[C]1(O)CCN2C(=O)CCc3cccc1c23 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | C[C@]1(CCN2c3c1cccc3CCC2=O)O |
| SMILES | OpenEye OEToolkits | 1.7.6 | CC1(CCN2c3c1cccc3CCC2=O)O |
