CAS 155418-05-6 appears in our catalog under these names: Nolpitantium Free Base, 1-[2-[(3S)-3-(3,4-Dichlorophenyl)-1-[2-[3-(1-methylethoxy)phenyl]acetyl]-3-piperidinyl]ethyl]-4-phenyl-1-azoniabicyclo[2.2.2]octane, 95%. Offered by: TargetMol, Chemat. Available pack sizes: 25mg, 50mg, 100mg, 1mg, 5mg.
1-[(3S)-3-(3,4-dichlorophenyl)-3-[2-(4-phenyl-1-azoniabicyclo[2.2.2]octan-1-yl)ethyl]piperidin-1-yl]-2-(3-propan-2-yloxyphenyl)ethanone (CAS 155418-05-6) is a chemical compound with the molecular formula C37H45Cl2N2O2+ and a molecular weight of 620.7 g/mol. IUPAC name: 1-[(3S)-3-(3,4-dichlorophenyl)-3-[2-(4-phenyl-1-azoniabicyclo[2.2.2]octan-1-yl)ethyl]piperidin-1-yl]-2-(3-propan-2-yloxyphenyl)ethanone. InChIKey: RPDFDSQFBCJTDY-GAQXSTBRSA-N.
| Molecular formula | C37H45Cl2N2O2+ |
|---|---|
| Molecular weight | 620.7 g/mol |
| IUPAC name | 1-[(3S)-3-(3,4-dichlorophenyl)-3-[2-(4-phenyl-1-azoniabicyclo[2.2.2]octan-1-yl)ethyl]piperidin-1-yl]-2-(3-propan-2-yloxyphenyl)ethanone |
| InChIKey | RPDFDSQFBCJTDY-GAQXSTBRSA-N |
| SMILES | CC(C)OC1=CC=CC(=C1)CC(=O)N2CCC[C@](C2)(CC[N+]34CCC(CC3)(CC4)C5=CC=CC=C5)C6=CC(=C(C=C6)Cl)Cl |
Computed by PubChem (NCBI)