A1LXQ
Summary
| Name: | dimethyl 5-(4-oxidanylidene-5~{H}-furo[3,2-c]pyridin-2-yl)benzene-1,3-dicarboxylate |
| Formula: | C17 H13 N O6 |
| Formal charge: | 0 |
| Formula weight: | 327.288 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | dimethyl 5-(4-oxidanylidene-5~{H}-furo[3,2-c]pyridin-2-yl)benzene-1,3-dicarboxylate |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C17H13NO6/c1-22-16(20)10-5-9(6-11(7-10)17(21)23-2)14-8-12-13(24-14)3-4-18-15(12)19/h3-8H,1-2H3,(H,18,19) |
| InChIKey | InChI | 1.06 | RYAJKWVOTXPFPC-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COC(=O)c1cc(cc(c1)c2oc3C=CNC(=O)c3c2)C(=O)OC |
| SMILES | CACTVS | 3.385 | COC(=O)c1cc(cc(c1)c2oc3C=CNC(=O)c3c2)C(=O)OC |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COC(=O)c1cc(cc(c1)C(=O)OC)c2cc3c(o2)C=CNC3=O |
| SMILES | OpenEye OEToolkits | 2.0.7 | COC(=O)c1cc(cc(c1)C(=O)OC)c2cc3c(o2)C=CNC3=O |
