| SpectraBase Spectrum ID |
8Jf6FH7M8s2 |
| Name |
5-Bromo-N-((1R,4R,5S)-4-((tetrahydro-2H-pyran-2-yl)oxy)-5-(2,2,2-trichloroacetamido)cyclopent-2-en-1-yl)-1H-pyrrole-2-carboxamide |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H19BrCl3N3O4 |
| InChI |
InChI=1S/C17H19BrCl3N3O4/c18-12-7-5-10(22-12)15(25)23-9-4-6-11(28-13-3-1-2-8-27-13)14(9)24-16(26)17(19,20)21/h4-7,9,11,13-14,22H,1-3,8H2,(H,23,25)(H,24,26)/t9-,11-,13?,14+/m1/s1 |
| InChIKey |
GPPDSZAEAXGCIP-SUFHQJMPSA-N |
| Literature Reference DOI |
10.1021/ol900799e |
| Molecular Weight |
515.619 g/mol |
| SMILES |
N([C@@]1([C@@](C=C[C@]1(NC(c1ccc([nH]1)Br)=O)[H])(OC1OCCCC1)[H])[H])C(C(Cl)(Cl)Cl)=O |
| SPLASH |
splash10-000i-9340200000-7423d544f386880a139d |
| Source of Spectrum |
A1-11-2687/SMS11-16 |
| Synonyms |
5-Bromo-N-[(1R,4R,5S)-4-(2-oxanyloxy)-5-[(2,2,2-trichloro-1-oxoethyl)amino]-1-cyclopent-2-enyl]-1H-pyrrole-2-carboxamide
5-Bromo-N-[(1R,4R,5S)-4-(oxan-2-yloxy)-5-[(2,2,2-trichloroacetyl)amino]cyclopent-2-en-1-yl]-1H-pyrrole-2-carboxamide
5-Bromanyl-N-[(1R,4R,5S)-4-(oxan-2-yloxy)-5-[2,2,2-tris(chloranyl)ethanoylamino]cyclopent-2-en-1-yl]-1H-pyrrole-2-carboxamide |
| Wiley ID |
1756815 |
