| Properties | Image |
| MNX_ID | MNXM30503 |
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| reference | chebi:39310 |
| formula | C22H18Cl2FNO3 |
| global charge | 0 |
| mol weight | 434.294 |
| InChIKey | QQODLKZGRKWIFG-ZAAXVRCTSA-N |
| InChI | InChI=1S/C22H18Cl2FNO3/c1-22(2)15(11-19(23)24)20(22)21(27)29-18(12-26)13-8-9-16(25)17(10-13)28-14-6-4-3-5-7-14/h3-11,15,18,20H,1-2H3/t15-,18-,20+/m0/s1 |
| SMILES | CC1(C)[C@@H](C=C(Cl)Cl)[C@@H]1C(=O)O[C@@H](C#N)C1=CC(OC2=CC=CC=C2)=C(F)C=C1 |
MNX internals
| InChI (mnx) | InChI=1/C22H18Cl2FNO3/c1-22(2)15(11-19(23)24)20(22)21(27)29-18(12-26)13-8-9-16(25)17(10-13)28-14-6-4-3-5-7-14/h3-11,15,18,20H,1-2H3/t15-,18-,20+/m0/s1 |
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| SMILES (mnx) | [CH3:1][C:22]1([CH3:2])[C@@H:15]([CH:11]=[C:19]([Cl:23])[Cl:24])[C@@H:20]1[C:21](=[O:27])[O:29][C@@H:18]([C:12]#[N:26])[C:13]1=[CH:10][C:17]([O:28][C:14]2=[CH:6][CH:4]=[CH:3][CH:5]=[CH:7]2)=[C:16]([F:25])[CH:9]=[CH:8]1 |
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