A1CWT
Summary
| Name: | 4-phenylmorpholin-3-one |
| Formula: | C10 H11 N O2 |
| Formal charge: | 0 |
| Formula weight: | 177.2 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 14.52 | 4-phenylmorpholin-3-one |
| OpenEye OEToolkits | 3.1.0.0 | 4-phenylmorpholin-3-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 14.52 | O=C1COCCN1c1ccccc1 |
| InChI | InChI | 1.06 | InChI=1S/C10H11NO2/c12-10-8-13-7-6-11(10)9-4-2-1-3-5-9/h1-5H,6-8H2 |
| InChIKey | InChI | 1.06 | SIWXCJHUZAEIAE-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C1COCCN1c2ccccc2 |
| SMILES | CACTVS | 3.385 | O=C1COCCN1c2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 3.1.0.0 | c1ccc(cc1)N2CCOCC2=O |
| SMILES | OpenEye OEToolkits | 3.1.0.0 | c1ccc(cc1)N2CCOCC2=O |
