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dywsrx

木虫 (小有名气)

[交流] 【求助/交流】原料药名称

与此图中的化学结构式匹配的原料药品名称叫什么?制剂也行,谢谢!
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kidant

木虫 (正式写手)

just do it now!



dywsrx(金币+1,VIP+0):谢谢! 9-2 23:45
EINECS 246-858-1,endo-8-Methyl-8-azabicyclo(3.2.1)oct-3-yl 2-propylval

EINECS 246-858-1
endo-8-Methyl-8-azabicyclo(3.2.1)oct-3-yl 2-propylvalerate
25333-49-7

[Structure]




[ Properties Computed from Structure]

Molecular Weight 267.40696 [g/mol]
Molecular Formula C16H29NO2
XLogP 4
H-Bond Donor 0
H-Bond Acceptor 3
Rotatable Bond Count 7
Exact Mass 267.219829
MonoIsotopic Mass 267.219829
Topological Polar Surface Area 29.5
Heavy Atom Count 19
Formal Charge 0
Complexity 285
Isotope Atom Count 0
Defined Atom StereoCenter Count 2
Undefined Atom StereoCenter Count 0
Defined Bond StereoCenter Count 0
Undefined Bond StereoCenter Count 0
Covalently-Bonded Unit Count 1


[ Descriptors Computed from Structure]
IUPAC Name: [(1R,5S)-8-methyl-8-azabicyclo[3.2.1]octan-3-yl] 2-propylpentanoate
Canonical SMILES: CCCC(CCC)C(=O)OC1CC2CCC(C1)N2C
Isomeric SMILES: CCCC(CCC)C(=O)OC1C[C@H]2CC[C@@H](C1)N2C
InChI: InChI=1/C16H29NO2/c1-4-6-12(7-5-2)16(18)19-15-10-13-8-9-14(11-15)17(13)
3/h12-15H,4-11H2,1-3H3/t13-,14+,15?
2楼2009-05-25 11:45:13
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