KEGG   COMPOUND: C01285
Entry
C01285                      Compound                               
Name
2,6-Dichlorophenol-4-(2,3-dihydro-1,4-naphthoquinone imine);
4-(3,5-Dichloro-4-hydroxyphenylimino)tetralin-1-one
Formula
C16H11Cl2NO2
Exact mass
319.0167
Mol weight
320.17
Structure
Other DBs
PubChem: 4504
ChEBI: 134676
NIKKAJI: J2.732.102J
LinkDB
KCF data

ATOM        21
            1   C8y C    35.4114  -26.7471
            2   C2y C    36.6247  -26.0318
            3   C8y C    35.4114  -28.1456
            4   C8x C    34.1915  -26.0509
            5   N2b N    36.6184  -24.6394
            6   C1x C    37.8509  -26.7343
            7   C5x C    36.6375  -28.8545
            8   C8x C    34.1915  -28.8608
            9   C8x C    32.9910  -26.7471
            10  C8y C    36.6247  -23.2537
            11  C1x C    37.8637  -28.1520
            12  O5x O    36.6312  -30.2404
            13  C8x C    32.9910  -28.1456
            14  C8x C    35.4177  -22.5448
            15  C8x C    37.8382  -22.5448
            16  C8y C    35.4177  -21.1398
            17  C8y C    37.8382  -21.1398
            18  C8y C    36.6247  -20.4501
            19  X   Cl   34.2170  -20.4501
            20  X   Cl   39.0389  -20.4436
            21  O1a O    36.6184  -19.0577
BOND        23
            1     1   2 1
            2     1   3 2
            3     1   4 1
            4     2   5 2
            5     2   6 1
            6     3   7 1
            7     3   8 1
            8     4   9 2
            9     5  10 1
            10    6  11 1
            11    7  12 2
            12    8  13 2
            13   10  14 2
            14   10  15 1
            15   14  16 1
            16   15  17 2
            17   16  18 2
            18   16  19 1
            19   17  20 1
            20   18  21 1
            21    7  11 1
            22    9  13 1
            23   17  18 1

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