T56
Summary
Name: | (E)-3-dibenzofuran-4-yl-N-oxidanyl-prop-2-enamide |
Formula: | C15 H11 N O3 |
Formal charge: | 0 |
Formula weight: | 253.253 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | (~{E})-3-dibenzofuran-4-yl-~{N}-oxidanyl-prop-2-enamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.06 | InChI=1S/C15H11NO3/c17-14(16-18)9-8-10-4-3-6-12-11-5-1-2-7-13(11)19-15(10)12/h1-9,18H,(H,16,17)/b9-8+ |
InChIKey | InChI | 1.06 | KLEYDFVKAXXYIY-CMDGGOBGSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | ONC(=O)/C=C/c1cccc2c1oc3ccccc23 |
SMILES | CACTVS | 3.385 | ONC(=O)C=Cc1cccc2c1oc3ccccc23 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)c3cccc(c3o2)/C=C/C(=O)NO |
SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)c3cccc(c3o2)C=CC(=O)NO |