| SpectraBase Spectrum ID |
BWPrdwe4PZe |
| Name |
Methyl 4-{3-[4-(2-cyanoethyl)-1-piperazinyl]-2,5-dioxo-1-pyrrolidinyl}benzoate |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
370.164105200 u |
| Formula |
C19H22N4O4 |
| InChI |
InChI=1S/C19H22N4O4/c1-27-19(26)14-3-5-15(6-4-14)23-17(24)13-16(18(23)25)22-11-9-21(10-12-22)8-2-7-20/h3-6,16H,2,8-13H2,1H3 |
| InChIKey |
SYNKFPDNEUXASB-UHFFFAOYSA-N |
| Molecular Weight |
370.409 g/mol |
| SMILES |
COC(C=1C=CC(N2C(C(N3CCN(CC3)CCC#N)CC2=O)=O)=CC1)=O |
![Methyl 4-{3-[4-(2-cyanoethyl)-1-piperazinyl]-2,5-dioxo-1-pyrrolidinyl}benzoate](/api/spectrum/BWPrdwe4PZe/structure.png?h=300&w=458 "Methyl 4-{3-[4-(2-cyanoethyl)-1-piperazinyl]-2,5-dioxo-1-pyrrolidinyl}benzoate")
