| Entry |
|
|---|
| Name |
Talniflumate (USAN/INN);
Somalgen (TN) |
|---|
| Formula |
C21H13F3N2O4
|
|---|
| Exact mass |
414.0827
|
|---|
| Mol weight |
414.33
|
|---|
| Structure |
|
|---|
| Efficacy |
Analgesic, Anti-inflammatory |
|---|
| Comment |
Anilinonicotinic acid derivative
|
|---|
| Other DBs |
|
|---|
| LinkDB |
|
|---|
| KCF data |
ATOM 30
1 C8x C 9.7300 -23.1700
2 C8x C 9.7300 -24.5700
3 C8x C 10.9424 -25.2700
4 N5x N 12.1549 -24.5700
5 C8y C 12.1549 -23.1700
6 C8y C 10.9424 -22.4700
7 N1b N 13.3860 -22.4590
8 C8y C 14.5912 -23.1547
9 C8x C 14.5916 -24.5696
10 C8x C 15.8042 -25.2693
11 C8x C 17.0165 -24.5689
12 C8y C 17.0160 -23.1539
13 C8x C 15.8034 -22.4543
14 C1d C 18.2285 -22.4539
15 X F 17.5285 -21.2415
16 X F 18.9285 -23.6664
17 X F 19.4409 -21.7539
18 C7a C 10.9424 -21.0700
19 O7a O 12.1379 -20.3796
20 O6a O 9.7133 -20.3602
21 C1y C 12.1379 -18.9796
22 C8y C 13.2565 -18.1666
23 C8y C 12.8289 -16.8515
24 C7x C 11.4460 -16.8518
25 O7x O 11.0190 -18.1670
26 C8x C 14.6260 -18.4573
27 C8x C 15.5625 -17.4167
28 C8x C 15.1349 -16.1016
29 C8x C 13.7655 -15.8109
30 O6a O 10.6437 -15.7472
BOND 33
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 5 7 1
8 7 8 1
9 8 9 2
10 9 10 1
11 10 11 2
12 11 12 1
13 12 13 2
14 8 13 1
15 12 14 1
16 14 15 1
17 14 16 1
18 14 17 1
19 6 18 1
20 18 19 1
21 18 20 2
22 19 21 1
23 21 22 1
24 22 23 1
25 23 24 1
26 24 25 1
27 21 25 1
28 22 26 2
29 26 27 1
30 27 28 2
31 28 29 1
32 23 29 2
33 24 30 2
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|---|
