JFC
Summary
Name: | ethyl 1-(2-morpholin-4-ylethyl)-5-pyridin-4-yl-indole-2-carboxylate |
Formula: | C22 H25 N3 O3 |
Formal charge: | 0 |
Formula weight: | 379.452 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | ethyl 1-(2-morpholin-4-ylethyl)-5-pyridin-4-yl-indole-2-carboxylate |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C22H25N3O3/c1-2-28-22(26)21-16-19-15-18(17-5-7-23-8-6-17)3-4-20(19)25(21)10-9-24-11-13-27-14-12-24/h3-8,15-16H,2,9-14H2,1H3 |
InChIKey | InChI | 1.06 | QBLOLELCAHJBDE-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | CCOC(=O)c1cc2cc(ccc2n1CCN3CCOCC3)c4ccncc4 |
SMILES | CACTVS | 3.385 | CCOC(=O)c1cc2cc(ccc2n1CCN3CCOCC3)c4ccncc4 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCOC(=O)c1cc2cc(ccc2n1CCN3CCOCC3)c4ccncc4 |
SMILES | OpenEye OEToolkits | 2.0.7 | CCOC(=O)c1cc2cc(ccc2n1CCN3CCOCC3)c4ccncc4 |