| Stereochemistry | ACHIRAL |
| Molecular Formula | C11H15N5O3 |
| Molecular Weight | 265.2685 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
![Structure of 7-[2-(N-Acetylamino)ethyl]theophylline](/img/9a338cce-66f7-4e37-8303-50b78bf0534f.svg?size=400&version=5&stereo=false "Structure of 7-[2-(N-Acetylamino)ethyl]theophylline")
SMILES
CN1C2=C(N(CCNC(C)=O)C=N2)C(=O)N(C)C1=O
InChI
InChIKey=XNAXSFXISYNXCH-UHFFFAOYSA-N
InChI=1S/C11H15N5O3/c1-7(17)12-4-5-16-6-13-9-8(16)10(18)15(3)11(19)14(9)2/h6H,4-5H2,1-3H3,(H,12,17)
| Molecular Formula | C11H15N5O3 |
| Molecular Weight | 265.2685 |
| Charge | 0 |
| Count |
MOL RATIO
1 MOL RATIO (average) |
| Stereochemistry | ACHIRAL |
| Additional Stereochemistry | No |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Optical Activity | NONE |
