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Propanolol TMS derivative 3-naphthalen-1-yloxy-N-propan-2-yl-2-trimeth

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摘 要:Propanolol TMS derivative 3-naphthalen-1-yloxy-N-propan-2-yl-2-trimethylsilyloxypropan-1-amine,Canonical SMILES: CC(C)NCC(COC1=CC=CC2=CC=CC=C21)O[Si](C)(C)C,InChI: InChI=1/C19H29NO2Si/c1-15(2)20-13-17(22-23(3,,4)5)14-21-19-12-8-10-16-9-6-7-11-18(16)1
[Synonyms]
Propanolol TMS derivative
[Structure]
Propanolol TMS derivative 3-naphthalen-1-yloxy-N-propan-2-yl-2-trimeth

[ Properties Computed from Structure]
Molecular Weight331.52456 [g/mol]
Molecular FormulaC19H29NO2Si
H-Bond Donor1
H-Bond Acceptor3
Rotatable Bond Count8
Exact Mass331.196756
MonoIsotopic Mass331.196756
Topological Polar Surface Area30.5
Heavy Atom Count23
Formal Charge0
Complexity343
Isotope Atom Count0
Defined Atom StereoCenter Count0
Undefined Atom StereoCenter Count1
Defined Bond StereoCenter Count0
Undefined Bond StereoCenter Count0
Covalently-Bonded Unit Count1

[ Descriptors Computed from Structure]
IUPAC Name: 3-naphthalen-1-yloxy-N-propan-2-yl-2-trimethylsilyloxypropan-1-amine
Canonical SMILES: CC(C)NCC(COC1=CC=CC2=CC=CC=C21)O[Si](C)(C)C
InChI: InChI=1/C19H29NO2Si/c1-15(2)20-13-17(22-23(3,
4)5)14-21-19-12-8-10-16-9-6-7-11-18(16)19/h6-12,15,17,20H,13-14H2,1-5H3

 
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