| SpectraBase Spectrum ID |
KDt0DuajCVr |
| Name |
2-[2-[2-amino-5-(methylcarbamoyl)phenyl]ethynyl]benzoic acid methyl ester |
| Alternate Name(s) |
methyl 2-[2-[2-amino-5-(methylcarbamoyl)phenyl]ethynyl]benzoate
methyl 2-[2-[2-azanyl-5-(methylcarbamoyl)phenyl]ethynyl]benzoate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H16N2O3 |
| InChI |
InChI=1S/C18H16N2O3/c1-20-17(21)14-9-10-16(19)13(11-14)8-7-12-5-3-4-6-15(12)18(22)23-2/h3-6,9-11H,19H2,1-2H3,(H,20,21) |
| InChIKey |
XPQXVXVFPQUNOR-UHFFFAOYSA-N |
| Molecular Weight |
308.337 g/mol |
| SMILES |
N(C(c1cc(c(cc1)N)C#Cc1c(C(=O)OC)cccc1)=O)C |
| SPLASH |
splash10-004i-0093000000-bfc9ab70130e087650b8 |
| Source of Spectrum |
F-68-1850-17 |
| Wiley ID |
1571966 |
![2-[2-[2-amino-5-(methylcarbamoyl)phenyl]ethynyl]benzoic acid methyl ester](/api/spectrum/KDt0DuajCVr/structure.png?h=300&w=458 "2-[2-[2-amino-5-(methylcarbamoyl)phenyl]ethynyl]benzoic acid methyl ester")
