| Properties | Image |
| MNX_ID | MNXM478621 |
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| reference | chebi:125542 |
| formula | C12H13BrN2O |
| global charge | 0 |
| mol weight | 281.153 |
| InChIKey | TZRUZONGYSVOGE-UHFFFAOYSA-N |
| InChI | InChI=1S/C12H13BrN2O/c13-7-12(16)14-6-5-9-8-15-11-4-2-1-3-10(9)11/h1-4,8,15H,5-7H2,(H,14,16) |
| SMILES | O=C(CBr)NCCC1=CNC2=CC=CC=C12 |
MNX internals
| InChI (mnx) | InChI=1/C12H13BrN2O/c13-7-12(16)14-6-5-9-8-15-11-4-2-1-3-10(9)11/h1-4,8,15H,5-7H2,(H,14,16) |
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| SMILES (mnx) | [CH:1]1=[CH:2][CH:4]=[C:11]2[C:10](=[CH:3]1)[C:9]([CH2:5][CH2:6][N:14]=[C:12]([CH2:7][Br:13])[OH:16])=[CH:8][NH:15]2 |
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