CAS 1504558-72-8 is the registry number for Nec-3a. Offered by: MedChemExpress. Available pack sizes: Get quote.
1-[(3S,3aS)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-8-methoxy-3,3a,4,5-tetrahydrobenzo[g]indazol-2-yl]-2-hydroxyethanone (CAS 1504558-72-8) is a chemical compound with the molecular formula C21H18F4N2O4 and a molecular weight of 438.4 g/mol. IUPAC name: 1-[(3S,3aS)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-8-methoxy-3,3a,4,5-tetrahydrobenzo[g]indazol-2-yl]-2-hydroxyethanone. InChIKey: RPGVJSZQQKMKSB-JLTOFOAXSA-N.
| Molecular formula | C21H18F4N2O4 |
|---|---|
| Molecular weight | 438.4 g/mol |
| IUPAC name | 1-[(3S,3aS)-3-[3-fluoro-4-(trifluoromethoxy)phenyl]-8-methoxy-3,3a,4,5-tetrahydrobenzo[g]indazol-2-yl]-2-hydroxyethanone |
| InChIKey | RPGVJSZQQKMKSB-JLTOFOAXSA-N |
| SMILES | COC1=CC2=C(CC[C@@H]3C2=NN([C@@H]3C4=CC(=C(C=C4)OC(F)(F)F)F)C(=O)CO)C=C1 |
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