ZL9
Summary
| Name: | 6-[3-[2-(2-methoxyphenoxy)ethylamino]propoxy]-4~{H}-1,4-benzoxazin-3-one |
| Formula: | C20 H24 N2 O5 |
| Formal charge: | 0 |
| Formula weight: | 372.415 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 6-[3-[2-(2-methoxyphenoxy)ethylamino]propoxy]-4~{H}-1,4-benzoxazin-3-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C20H24N2O5/c1-24-18-5-2-3-6-19(18)26-12-10-21-9-4-11-25-15-7-8-17-16(13-15)22-20(23)14-27-17/h2-3,5-8,13,21H,4,9-12,14H2,1H3,(H,22,23) |
| InChIKey | InChI | 1.06 | JIDGHQZPZOREIN-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COc1ccccc1OCCNCCCOc2ccc3OCC(=O)Nc3c2 |
| SMILES | CACTVS | 3.385 | COc1ccccc1OCCNCCCOc2ccc3OCC(=O)Nc3c2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COc1ccccc1OCCNCCCOc2ccc3c(c2)NC(=O)CO3 |
| SMILES | OpenEye OEToolkits | 2.0.7 | COc1ccccc1OCCNCCCOc2ccc3c(c2)NC(=O)CO3 |
