Name | Maropitant |
Iupac Chemical Name | (1R,2S,3S,4R)-2-benzhydryl-N-(5-(tert-butyl)-2-methoxybenzyl)quinuclidin-3-amine |
Synonyms | CJ-11,972; CJ 11,972; CJ11,972; CJ-11972; CJ 11972; CJ11972; Maropitant; |
Molecular Formula | C32H40N2O |
Molecular Weight | 468.6728 |
Smile | COC1=CC=C(C(C)(C)C)C=C1CN[C@@H]2[C@H](C(C3=CC=CC=C3)C4=CC=CC=C4)[N@]5CC[C@]2([H])CC5 |
InChiKey | OMPCVMLFFSQFIX-CONSDPRKSA-N |
InChi | InChI=1S/C32H40N2O/c1-32(2,3)27-15-16-28(35-4)26(21-27)22-33-30-25-17-19-34(20-18-25)31(30)29(23-11-7-5-8-12-23)24-13-9-6-10-14-24/h5-16,21,25,29-31,33H,17-20,22H2,1-4H3/t30-,31-/m0/s1 |
CAS Number | 147116-67-4 |
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