E2C
Summary
| Name: | 5-(2-chloranylphenoxazin-10-yl)-~{N},~{N}-diethyl-pentan-1-amine |
| Formula: | C21 H27 Cl N2 O |
| Formal charge: | 0 |
| Formula weight: | 358.905 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 5-(2-chloranylphenoxazin-10-yl)-~{N},~{N}-diethyl-pentan-1-amine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C21H27ClN2O/c1-3-23(4-2)14-8-5-9-15-24-18-10-6-7-11-20(18)25-21-13-12-17(22)16-19(21)24/h6-7,10-13,16H,3-5,8-9,14-15H2,1-2H3 |
| InChIKey | InChI | 1.03 | UVWATVYWPWOHHD-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCN(CC)CCCCCN1c2ccccc2Oc3ccc(Cl)cc13 |
| SMILES | CACTVS | 3.385 | CCN(CC)CCCCCN1c2ccccc2Oc3ccc(Cl)cc13 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCN(CC)CCCCCN1c2ccccc2Oc3c1cc(cc3)Cl |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCN(CC)CCCCCN1c2ccccc2Oc3c1cc(cc3)Cl |
