| Stereochemistry | ACHIRAL |
| Molecular Formula | C27H30N2O6S |
| Molecular Weight | 510.602 |
| Optical Activity | NONE |
| Defined Stereocenters | 0 / 0 |
| E/Z Centers | 0 |
| Charge | 0 |
SHOW SMILES / InChI
![Structure of 8-{[2-(diethylamino)ethyl]amino}-5-(hydroxymethyl)-9-oxo-9H-xanthen-2-yl 4-methylbenzene-1-sulfonate](/img/537584d4-66d5-4255-8e68-9de8bc0335de.svg?size=400&version=7&stereo=false "Structure of 8-{[2-(diethylamino)ethyl]amino}-5-(hydroxymethyl)-9-oxo-9H-xanthen-2-yl 4-methylbenzene-1-sulfonate")
SMILES
CCN(CC)CCNC1=CC=C(CO)C2=C1C(=O)C3=C(O2)C=CC(OS(=O)(=O)C4=CC=C(C)C=C4)=C3
InChI
InChIKey=QFLKRNMJXQIZEE-UHFFFAOYSA-N
InChI=1S/C27H30N2O6S/c1-4-29(5-2)15-14-28-23-12-8-19(17-30)27-25(23)26(31)22-16-20(9-13-24(22)34-27)35-36(32,33)21-10-6-18(3)7-11-21/h6-13,16,28,30H,4-5,14-15,17H2,1-3H3
| Molecular Formula | C27H30N2O6S |
| Molecular Weight | 510.602 |
| 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 |