LW7
Summary
| Name: | 1-(2-phenylethyl)-3,4-dihydroisoquinoline |
| Formula: | C17 H17 N |
| Formal charge: | 0 |
| Formula weight: | 235.324 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | 1-(2-phenylethyl)-3,4-dihydroisoquinoline |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C17H17N/c1-2-6-14(7-3-1)10-11-17-16-9-5-4-8-15(16)12-13-18-17/h1-9H,10-13H2 |
| InChIKey | InChI | 1.03 | GDEYQNLNJXESFX-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C1Cc2ccccc2C(=N1)CCc3ccccc3 |
| SMILES | CACTVS | 3.385 | C1Cc2ccccc2C(=N1)CCc3ccccc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1ccc(cc1)CCC2=NCCc3c2cccc3 |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1ccc(cc1)CCC2=NCCc3c2cccc3 |
