| Properties | Image |
| MNX_ID | MNXM338748 |
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| reference | chebi:128496 |
| formula | C24H26ClN3O3 |
| global charge | 0 |
| mol weight | 439.943 |
| InChIKey | JSXHTEDYJARPFB-NRFANRHFSA-N |
| InChI | InChI=1S/C24H26ClN3O3/c1-15(30)28-13-24(14-28)12-27(10-16-5-3-4-6-19(16)25)21(11-29)23-22(24)18-8-7-17(31-2)9-20(18)26-23/h3-9,21,26,29H,10-14H2,1-2H3/t21-/m0/s1 |
| SMILES | COC1=CC2=C(C=C1)C1=C(N2)[C@H](CO)N(CC2=CC=CC=C2Cl)CC12CN(C(C)=O)C2 |
MNX internals
| InChI (mnx) | InChI=1/C24H26ClN3O3/c1-15(30)28-13-24(14-28)12-27(10-16-5-3-4-6-19(16)25)21(11-29)23-22(24)18-8-7-17(31-2)9-20(18)26-23/h3-9,21,26,29H,10-14H2,1-2H3/t21-/m0/s1 |
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| SMILES (mnx) | [CH3:1][C:15]([N:28]1[CH2:13][C:24]2([CH2:12][N:27]([CH2:10][C:16]3=[CH:5][CH:3]=[CH:4][CH:6]=[C:19]3[Cl:25])[C@@H:21]([CH2:11][OH:29])[C:23]3=[C:22]2[C:18]2=[C:20]([CH:9]=[C:17]([O:31][CH3:2])[CH:7]=[CH:8]2)[NH:26]3)[CH2:14]1)=[O:30] |
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