E92
Summary
| Name: | ~{N}-(3-chlorophenyl)-4-oxidanylidene-chromene-3-carboxamide |
| Formula: | C16 H10 Cl N O3 |
| Formal charge: | 0 |
| Formula weight: | 299.709 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.6 | ~{N}-(3-chlorophenyl)-4-oxidanylidene-chromene-3-carboxamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C16H10ClNO3/c17-10-4-3-5-11(8-10)18-16(20)13-9-21-14-7-2-1-6-12(14)15(13)19/h1-9H,(H,18,20) |
| InChIKey | InChI | 1.03 | CVLFPXGWUQAEEW-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Clc1cccc(NC(=O)C2=COc3ccccc3C2=O)c1 |
| SMILES | CACTVS | 3.385 | Clc1cccc(NC(=O)C2=COc3ccccc3C2=O)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1ccc2c(c1)C(=O)C(=CO2)C(=O)Nc3cccc(c3)Cl |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1ccc2c(c1)C(=O)C(=CO2)C(=O)Nc3cccc(c3)Cl |
