| SpectraBase Spectrum ID |
4lvwJRz02hZ |
| Name |
2-(3-Methyl-2,5-dioxo-2,5-dihydro-pyrrol-1-yl)-benzoic acid (3R,4aS,8aS)-1-butyl-decahydro-quinolin-3-ylmethyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H34N2O4 |
| InChI |
InChI=1S/C26H34N2O4/c1-3-4-13-27-16-19(15-20-9-5-7-11-22(20)27)17-32-26(31)21-10-6-8-12-23(21)28-24(29)14-18(2)25(28)30/h6,8,10,12,14,19-20,22H,3-5,7,9,11,13,15-17H2,1-2H3/t19-,20+,22+/m1/s1 |
| InChIKey |
KTLWXVRUSYJPCB-URVUXULASA-N |
| Molecular Weight |
438.568 g/mol |
| SMILES |
C1(N(C(C(=C1)C)=O)c1c(C(OC[C@]2(CN(CCCC)[C@@]3([C@](C2)(CCCC3)[H])[H])[H])=O)cccc1)=O |
| SPLASH |
splash10-0a4j-9112000000-c49561b917a81ff50cff |
| Source of Spectrum |
U1-2009-1958-17c |
| Synonyms |
[(3S*,4aR*,8aR*)-1-(Butyl)decahydroquinolin-3-yl]methyl 2-(3-Methyl-2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)benzoate |
| Wiley ID |
1662778 |
