CAS Registry Number: 917562-23-3

Name:

1H-​Indole-​1,​7-​dicarboxylic acid, 1-​(1,​1-​dimethylethyl) 7-​methyl ester

Chemical Formula: C15H17NO4
Exact Mass: 275.12
Molecular Weight: 275.30
m/z: 275.12 (100.0%), 276.12 (16.6%), 277.12 (2.1%)

InChI: InChI=1S/C15H17NO4/c1-15(2,3)20-14(18)16-9-8-10-6-5-7-11(12(10)16)13(17)19-4/h5-9H,1-4H3
InChIKey: LFIINZZVXMUCCL-UHFFFAOYSA-N
Canonical SMILES : CC(C)(C)OC(=O)N1C=CC2=C1C(=CC=C2)C(=O)OC

Specification

98%

PCT Int. Appl. (2007), WO 2007117465 A2 20071018. 

Bioorganic & Medicinal Chemistry Letters (2011), 21(8), 2255-2258.