WVZ
Summary
| Name: | (1~{S})-1-phenyl-2,4-dihydro-1~{H}-isoquinolin-3-one |
| Formula: | C15 H13 N O |
| Formal charge: | 0 |
| Formula weight: | 223.27 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (1~{S})-1-phenyl-2,4-dihydro-1~{H}-isoquinolin-3-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C15H13NO/c17-14-10-12-8-4-5-9-13(12)15(16-14)11-6-2-1-3-7-11/h1-9,15H,10H2,(H,16,17)/t15-/m0/s1 |
| InChIKey | InChI | 1.06 | IAOCKKZVKNCZPK-HNNXBMFYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C1Cc2ccccc2[C@@H](N1)c3ccccc3 |
| SMILES | CACTVS | 3.385 | O=C1Cc2ccccc2[CH](N1)c3ccccc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)[C@H]2c3ccccc3CC(=O)N2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc(cc1)C2c3ccccc3CC(=O)N2 |
