KEGG   COMPOUND: C11495
Entry
C11495                      Compound                               
Name
Methyl 6-(4-isopropyl-4-methyl-5-oxo-2-imidazolin-2-yl)-m-toluate
Formula
C16H20N2O3
Exact mass
288.1474
Mol weight
288.3416
Structure
Other DBs
PubChem: 13665
ChEBI: 6853
NIKKAJI: J634.689H
LinkDB
KCF data

ATOM        21
            1   C2y C    28.2931  -19.8847
            2   N1x N    27.9290  -21.2322
            3   C5x C    29.0983  -21.9998
            4   C1z C    30.1877  -21.1222
            5   N2x N    29.6874  -19.8867
            6   C8y C    24.6623  -17.7831
            7   C8x C    24.6623  -19.1863
            8   C8x C    25.8743  -19.8844
            9   C8y C    27.0864  -19.1863
            10  C8y C    27.0864  -17.7831
            11  C8x C    25.8743  -17.0779
            12  C7a C    28.2936  -17.0850
            13  O7a O    29.5065  -17.7902
            14  O6a O    28.2867  -15.6817
            15  C1a C    30.7194  -17.0779
            16  C1c C    31.3892  -21.8234
            17  C1a C    32.6021  -21.1183
            18  C1a C    31.3821  -23.2267
            19  C1a C    31.1706  -20.1171
            20  O5x O    29.0906  -23.4029
            21  C1a C    23.4521  -17.0870
BOND        22
            1    10  11 2
            2    11   6 1
            3    10  12 1
            4     1   2 1
            5    12  13 1
            6     2   3 1
            7    12  14 2
            8     3   4 1
            9    13  15 1
            10    9   1 1
            11    4   5 1
            12    4  16 1
            13    5   1 2
            14   16  17 1
            15    6   7 2
            16   16  18 1
            17    7   8 1
            18    4  19 1
            19    8   9 2
            20    3  20 2
            21    9  10 1
            22    6  21 1

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