FHH
Summary
Name: | methyl 4-[(2-oxidanylidene-1,5,6,7-tetrahydrocyclopenta[b]pyridin-3-yl)carbonylamino]butanoate |
Formula: | C14 H18 N2 O4 |
Formal charge: | 0 |
Formula weight: | 278.304 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | methyl 4-[(2-oxidanylidene-1,5,6,7-tetrahydrocyclopenta[b]pyridin-3-yl)carbonylamino]butanoate |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C14H18N2O4/c1-20-12(17)6-3-7-15-13(18)10-8-9-4-2-5-11(9)16-14(10)19/h8H,2-7H2,1H3,(H,15,18)(H,16,19) |
InChIKey | InChI | 1.03 | LFOKUSURFOQCKJ-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | COC(=O)CCCNC(=O)C1=CC2=C(CCC2)NC1=O |
SMILES | CACTVS | 3.385 | COC(=O)CCCNC(=O)C1=CC2=C(CCC2)NC1=O |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | COC(=O)CCCNC(=O)C1=CC2=C(CCC2)NC1=O |
SMILES | OpenEye OEToolkits | 2.0.6 | COC(=O)CCCNC(=O)C1=CC2=C(CCC2)NC1=O |