KEGG   COMPOUND: C18878
Entry
C18878                      Compound                               
Name
Oxabetrinil
Formula
C12H12N2O3
Exact mass
232.0848
Mol weight
232.2353
Structure
Brite
Pesticides [BR:br08007]
 Pesticides
  Herbicides
   Others
    C18878  Oxabetrinil
Other DBs
CAS: 74782-23-3
PubChem: 124489550
ChEBI: 82027
KCF data

ATOM        17
            1   C1x C    12.0987  -16.3672
            2   C1x C    12.5158  -17.7036
            3   O2x O    13.9157  -17.7199
            4   C1y C    14.3638  -16.3935
            5   O2x O    13.2408  -15.5575
            6   C1b C    15.5624  -15.6800
            7   O2a O    16.7749  -16.3800
            8   N2b N    17.9873  -15.6800
            9   C2c C    19.1997  -16.3800
            10  C3b C    20.4122  -15.6800
            11  N3a N    21.6246  -14.9800
            12  C8y C    19.1997  -17.7799
            13  C8x C    17.9725  -18.4885
            14  C8x C    17.9726  -19.8885
            15  C8x C    19.1851  -20.5884
            16  C8x C    20.4124  -19.8798
            17  C8x C    20.4122  -18.4798
BOND        18
            1     1   2 1
            2     2   3 1
            3     3   4 1
            4     4   5 1
            5     1   5 1
            6     4   6 1
            7     6   7 1
            8     7   8 1
            9     8   9 2
            10    9  10 1
            11   10  11 3
            12    9  12 1
            13   12  13 2
            14   13  14 1
            15   14  15 2
            16   15  16 1
            17   16  17 2
            18   12  17 1

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