E0K
Summary
| Name: | (2R)-2-(cyclopropylmethyl)-7-(3,5-dimethyl-1,2-oxazol-4-yl)-4H-1,4-benzoxazin-3-one |
| Formula: | C17 H18 N2 O3 |
| Formal charge: | 0 |
| Formula weight: | 298.336 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | (2~{R})-2-(cyclopropylmethyl)-7-(3,5-dimethyl-1,2-oxazol-4-yl)-4~{H}-1,4-benzoxazin-3-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C17H18N2O3/c1-9-16(10(2)22-19-9)12-5-6-13-14(8-12)21-15(17(20)18-13)7-11-3-4-11/h5-6,8,11,15H,3-4,7H2,1-2H3,(H,18,20)/t15-/m1/s1 |
| InChIKey | InChI | 1.03 | CMSYOXFBNZPEJB-OAHLLOKOSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Cc1onc(C)c1c2ccc3NC(=O)[C@@H](CC4CC4)Oc3c2 |
| SMILES | CACTVS | 3.385 | Cc1onc(C)c1c2ccc3NC(=O)[CH](CC4CC4)Oc3c2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | Cc1c(c(on1)C)c2ccc3c(c2)O[C@@H](C(=O)N3)CC4CC4 |
| SMILES | OpenEye OEToolkits | 2.0.6 | Cc1c(c(on1)C)c2ccc3c(c2)OC(C(=O)N3)CC4CC4 |
