U65
Summary
| Name: | methyl 3~{a},4-dihydro-3~{H}-thieno[3,2-c]chromene-2-carboxylate |
| Formula: | C13 H10 O3 S |
| Formal charge: | 0 |
| Formula weight: | 246.282 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | methyl 4~{H}-thieno[3,2-c]chromene-2-carboxylate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C13H10O3S/c1-15-13(14)11-6-8-7-16-10-5-3-2-4-9(10)12(8)17-11/h2-6H,7H2,1H3 |
| InChIKey | InChI | 1.03 | SSWWLCIIZQNEAE-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COC(=O)c1sc2c(COc3ccccc23)c1 |
| SMILES | CACTVS | 3.385 | COC(=O)c1sc2c(COc3ccccc23)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COC(=O)c1cc2c(s1)-c3ccccc3OC2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | COC(=O)c1cc2c(s1)-c3ccccc3OC2 |
