| MolName | N-[(Z)-[(Z)-3-(2-nitrophenyl)prop-2-enylidene]amino]furan-2-carboxamide |
| MolecularFormula | C14H11N3O4 |
| Smiles | [O-][N+](c1c(/C=C\C=N/NC(c2ccco2)=O)cccc1)=O |
| InChI | InChI=1S/C14H11N3O4/c18-14(13-8-4-10-21-13)16-15-9-3-6-11-5-1-2-7-12(11)17(19)20/h1-10H,(H,16,18) |
| InChIK | WAFSNRUAUKQONC-UHFFFAOYSA-N |
| TotalMolweight | 285.258 |
| Molweight | 285.258 |
| MonoisotopicMass | 285.074957 |
| CLogP | 1.487 |
| CLogS | -4.155 |
| H Acceptors | 7 |
| H Donors | 1 |
| TotalSurfaceArea | 226.85 |
| Relative PSA | 0.35504 |
| PolarSurfaceArea | 100.42 |
| Druglikeness | -0.62309 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | aromatic nitro; acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.61905 |
| Fragments | 1 |
| Non HAtoms | 21 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 5 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 1 |
| AcidicOxygens | 1 |
| StereoCon |
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1 - N-[(Z)-[(Z)-3-(2-nitrophenyl)prop-2-enylidene]amino]furan-2-carboxamide | 2 - N-[(Z)-[(Z)-3-(2-nitrophenyl)prop-2-enylidene]amino]furan-2-carboxamide