| SpectraBase Spectrum ID |
5cyC6AHCEUm |
| Name |
1-Chloro-3,7-(4-phenyl-3,5-dioxo-1,2,4-triazolo)cycloheptene |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H14ClN3O2 |
| InChI |
InChI=1S/C15H14ClN3O2/c16-12-9-11-7-4-8-13(12)19-15(21)17(14(20)18(11)19)10-5-2-1-3-6-10/h1-3,5-6,9,11,13H,4,7-8H2/t11-,13+/m0/s1 |
| InChIKey |
CPTFXCOBOBXGEA-WCQYABFASA-N |
| Molecular Weight |
303.749 g/mol |
| SMILES |
C1(N(C(N2[C@@]3(C=C([C@](N12)(CCC3)[H])Cl)[H])=O)c1ccccc1)=O |
| SPLASH |
splash10-000i-0495000000-b6ec289a8c3b92bf0b05 |
| Source of Spectrum |
KC-1993-956-47 |
| Synonyms |
(1S,7S)-11-Chloro-4-phenyl-2,4,6-triaza-tricyclo[5.3.2.0*2,6*]dodec-11-ene-3,5-dione
(1S,7S)-11-chloro-4-phenyl-2,4,6-triazatricyclo[5.3.2.0(2,6)]dodec-11-ene-3,5-dione
1-Chloro-3,7-(4-phenyl-3,5-dioxo-1,2-dihydro-1,2,4-triazolo-1,2-diyl)cycloheptene |
| Wiley ID |
779287 |
