CAS Registry Number: 763114-26-7

Name:

Benzoic acid, 5-​[(3,​4-​dihydro-​4-​oxo-​1-​phthalazinyl)​methyl]​-​2-​fluoro-
2-​Fluoro-​5-​(4-​oxo-​3,​4-​dihydrophthalazin-​1-​ylmethyl)​benzoic acid 

Chemical Formula: C16H11FN2O3
Exact Mass: 298.08
Molecular Weight: 298.27
m/z: 298.08 (100.0%), 299.08 (17.5%), 300.08 (2.2%)

InChI: InChI=1S/C16H11FN2O3/c17-13-6-5-9(7-12(13)16(21)22)8-14-10-3-1-2-4-11(10)15(20)19-18-14/h1-7H,8H2,(H,19,20)(H,21,22)
InChIKey: PAXLJNGPFJEKQX-UHFFFAOYSA-N
Canonical SMILES : C1=CC=C2C(=C1)C(=NNC2=O)CC3=CC(=C(C=C3)F)C(=O)O

Specification

98%

1. (1) Menear, Keith A.; Journal of Medicinal Chemistry 2008, V51(20), P6581-6591 CAPLUS