| Properties | Image |
| MNX_ID | MNXM67651 |
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| reference | keggD:D05367 |
| formula | C17H17Cl3N2O3 |
| global charge | 0 |
| mol weight | 403.693 |
| InChIKey | ZDZOAQMHMJXDBU-SATBOSKTSA-N |
| InChI | InChI=1S/C17H16Cl2N2O3.ClH/c1-2-7-22-9-14-10-23-17(24-14,11-21-6-5-20-12-21)15-4-3-13(18)8-16(15)19;/h1,3-6,8,12,14H,7,9-11H2;1H/t14-,17-;/m1./s1 |
| SMILES | C#CCOC[C@@H]1CO[C@@](CN2C=CN=C2)(C2=C(Cl)C=C(Cl)C=C2)O1.Cl |
MNX internals
| InChI (mnx) | InChI=1/C17H16Cl2N2O3.ClH/c1-2-7-22-9-14-10-23-17(24-14,11-21-6-5-20-12-21)15-4-3-13(18)8-16(15)19;/h1,3-6,8,12,14H,7,9-11H2;1H/t14-,17-;/m1./s1 |
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| SMILES (mnx) | [CH:1]#[C:2][CH2:7][O:22][CH2:9][C@@H:14]1[CH2:10][O:23][C@@:17]([CH2:11][N:21]2[CH:6]=[CH:5][N:20]=[CH:12]2)([C:15]2=[C:16]([Cl:19])[CH:8]=[C:13]([Cl:18])[CH:3]=[CH:4]2)[O:24]1.[ClH:25] |
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