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WV 1141,LS-103787,p-Cymene, 2-chloro-5-(2-(N,N-di-(2-propyl)amino)etho

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摘 要:WV 1141,LS-103787,p-Cymene, 2-chloro-5-(2-(N,N-di-(2-propyl)amino)ethoxy)-, hydrochloride,4-Chloro-beta-(N,N-diisopropylamino)-2-isopropyl-5-methylphenetole hydrochloride,Phenetole, 4-chloro-beta-(N,N-diisopropylamino)-2-isopropyl-5-methyl-, hydrochl
[Synonyms]
WV 1141
LS-103787
p-Cymene, 2-chloro-5-(2-(N,N-di-(2-propyl)amino)ethoxy)-, hydrochloride
4-Chloro-beta-(N,N-diisopropylamino)-2-isopropyl-5-methylphenetole hydrochloride
Phenetole, 4-chloro-beta-(N,N-diisopropylamino)-2-isopropyl-5-methyl-, hydrochloride
16793-75-2

[Structure]
WV 1141,LS-103787,p-Cymene, 2-chloro-5-(2-(N,N-di-(2-propyl)amino)etho

[ Properties Computed from Structure]
Molecular Weight348.35084 [g/mol]
Molecular FormulaC18H31Cl2NO
H-Bond Donor1
H-Bond Acceptor2
Rotatable Bond Count7
Exact Mass347.17827
MonoIsotopic Mass347.17827
Topological Polar Surface Area12.5
Heavy Atom Count22
Formal Charge0
Complexity285
Isotope Atom Count0
Defined Atom StereoCenter Count0
Undefined Atom StereoCenter Count0
Defined Bond StereoCenter Count0
Undefined Bond StereoCenter Count0
Covalently-Bonded Unit Count2

[ Descriptors Computed from Structure]
IUPAC Name: N-[2-(4-chloro-5-methyl-2-propan-2-ylphenoxy)ethyl]-N-propan-2-ylpropan-
2-amine hydrochloride
Canonical SMILES: CC1=CC(=C(C=C1Cl)C(C)C)OCCN(C(C)C)C(C)C.Cl
InChI: InChI=1/C18H30ClNO.ClH/c1-12(2)16-11-17(19)15(7)10-18(16)21-9-8-20(13(3)
4)14(5)6;/h10-14H,8-9H2,1-7H3;1H

 
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