DLH
Summary
| Name: | 2-(4-chlorophenyl)-1-spiro[1,3-benzodioxole-2,4'-piperidine]-1'-yl-ethanone |
| Formula: | C19 H18 Cl N O3 |
| Formal charge: | 0 |
| Formula weight: | 343.804 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 2-(4-chlorophenyl)-1-spiro[1,3-benzodioxole-2,4'-piperidine]-1'-yl-ethanone |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C19H18ClNO3/c20-15-7-5-14(6-8-15)13-18(22)21-11-9-19(10-12-21)23-16-3-1-2-4-17(16)24-19/h1-8H,9-13H2 |
| InChIKey | InChI | 1.03 | FYEGABNDKDAYPJ-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Clc1ccc(CC(=O)N2CCC3(CC2)Oc4ccccc4O3)cc1 |
| SMILES | CACTVS | 3.385 | Clc1ccc(CC(=O)N2CCC3(CC2)Oc4ccccc4O3)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1ccc2c(c1)OC3(O2)CCN(CC3)C(=O)Cc4ccc(cc4)Cl |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1ccc2c(c1)OC3(O2)CCN(CC3)C(=O)Cc4ccc(cc4)Cl |
