F4E
Summary
Name: | methyl 4~{H}-furo[3,2-b]pyrrole-5-carboxylate |
Formula: | C8 H7 N O3 |
Formal charge: | 0 |
Formula weight: | 165.146 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | methyl 4~{H}-furo[3,2-b]pyrrole-5-carboxylate |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C8H7NO3/c1-11-8(10)6-4-7-5(9-6)2-3-12-7/h2-4,9H,1H3 |
InChIKey | InChI | 1.03 | LIIJOCBTGRORSY-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | COC(=O)c1[nH]c2ccoc2c1 |
SMILES | CACTVS | 3.385 | COC(=O)c1[nH]c2ccoc2c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | COC(=O)c1cc2c([nH]1)cco2 |
SMILES | OpenEye OEToolkits | 2.0.6 | COC(=O)c1cc2c([nH]1)cco2 |