| Properties | Image |
| MNX_ID | MNXM172869 |
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| reference | chebi:130675 |
| formula | C15H19BrN2O2 |
| global charge | 0 |
| mol weight | 339.233 |
| InChIKey | YPNLXOUGQFNUKR-KCQAQPDRSA-N |
| InChI | InChI=1S/C15H19BrN2O2/c1-2-17-7-12-15(10-3-5-11(16)6-4-10)13(9-19)18(12)14(20)8-17/h3-6,12-13,15,19H,2,7-9H2,1H3/t12-,13-,15+/m0/s1 |
| SMILES | CCN1CC(=O)N2[C@@H](CO)[C@H](C3=CC=C(Br)C=C3)[C@@H]2C1 |
MNX internals
| InChI (mnx) | InChI=1/C15H19BrN2O2/c1-2-17-7-12-15(10-3-5-11(16)6-4-10)13(9-19)18(12)14(20)8-17/h3-6,12-13,15,19H,2,7-9H2,1H3/t12-,13-,15+/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:2][N:17]1[CH2:7][C@H:12]2[C@@H:15]([C:10]3=[CH:4][CH:6]=[C:11]([Br:16])[CH:5]=[CH:3]3)[C@H:13]([CH2:9][OH:19])[N:18]2[C:14](=[O:20])[CH2:8]1 |
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