TB5
Summary
| Name: | 4-(4-pyrrol-1-ylphenyl)morpholine |
| Synonyms: | 4-[4-(1H-pyrrol-1-yl)phenyl]morpholine |
| Formula: | C14 H16 N2 O |
| Formal charge: | 0 |
| Formula weight: | 228.29 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 4-(4-pyrrol-1-ylphenyl)morpholine |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C14H16N2O/c1-2-8-15(7-1)13-3-5-14(6-4-13)16-9-11-17-12-10-16/h1-8H,9-12H2 |
| InChIKey | InChI | 1.03 | VJGOAQUQJGASLY-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | C1CN(CCO1)c2ccc(cc2)n3cccc3 |
| SMILES | CACTVS | 3.385 | C1CN(CCO1)c2ccc(cc2)n3cccc3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccn(c1)c2ccc(cc2)N3CCOCC3 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1ccn(c1)c2ccc(cc2)N3CCOCC3 |
