SpectraBase Spectrum ID |
Abipxj7AqpV |
Name |
2,2,2-trichloro-1,1-dimethylethyl 1-(Carboxymethyl)-5-methoxy-1,2-dihydrobenz[e]indole-3-carboxylate |
Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C20H20Cl3NO5 |
InChI |
InChI=1S/C20H20Cl3NO5/c1-19(2,20(21,22)23)29-18(27)24-10-11(8-16(25)26)17-13-7-5-4-6-12(13)15(28-3)9-14(17)24/h4-7,9,11H,8,10H2,1-3H3,(H,25,26) |
InChIKey |
LWWSRGBHWRNMPM-UHFFFAOYSA-N |
Molecular Weight |
460.741 g/mol |
SMILES |
OC(CC1CN(c2c1c1ccccc1c(c2)OC)C(OC(C(Cl)(Cl)Cl)(C)C)=O)=O |
SPLASH |
splash10-0002-2930100000-b4c24a9ae9acb1e9008e |
Source of Spectrum |
J-56-2244-22 |
Synonyms |
{5-methoxy-3-[(2,2,2-trichloro-1,1-dimethylethoxy)carbonyl]-2,3-dihydro-1H-benzo[e]indol-1-yl}acetic acid |
Wiley ID |
1390168 |