PZ0
Summary
| Name: | 1-[4-[(5-chloranyl-2-phenylmethoxy-phenyl)methoxy]phenyl]-N-methyl-methanamine |
| Formula: | C22 H22 Cl N O2 |
| Formal charge: | 0 |
| Formula weight: | 367.869 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 1-[4-[(5-chloranyl-2-phenylmethoxy-phenyl)methoxy]phenyl]-~{N}-methyl-methanamine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C22H22ClNO2/c1-24-14-17-7-10-21(11-8-17)25-16-19-13-20(23)9-12-22(19)26-15-18-5-3-2-4-6-18/h2-13,24H,14-16H2,1H3 |
| InChIKey | InChI | 1.06 | KKMPHNRWOFIHIE-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CNCc1ccc(OCc2cc(Cl)ccc2OCc3ccccc3)cc1 |
| SMILES | CACTVS | 3.385 | CNCc1ccc(OCc2cc(Cl)ccc2OCc3ccccc3)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CNCc1ccc(cc1)OCc2cc(ccc2OCc3ccccc3)Cl |
| SMILES | OpenEye OEToolkits | 2.0.7 | CNCc1ccc(cc1)OCc2cc(ccc2OCc3ccccc3)Cl |
