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BRN 0497234,LS-117103,1-(1H-Indol-3-yloxoacetyl)-4-phenyl-4-piperidino

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摘 要:BRN 0497234,LS-117103,1-(1H-Indol-3-yloxoacetyl)-4-phenyl-4-piperidinol,4-Piperidinol, 1-(1H-indol-3-yloxoacetyl)-4-phenyl-,5-22-06-00302 (Beilstein Handbook Reference),18272-07-6, 1-(4-hydroxy-4-phenylpiperidin-1-yl)-2-(1H-indol-3-yl)ethane-1,2-dion
[Synonyms]
BRN 0497234
LS-117103
1-(1H-Indol-3-yloxoacetyl)-4-phenyl-4-piperidinol
4-Piperidinol, 1-(1H-indol-3-yloxoacetyl)-4-phenyl-
5-22-06-00302 (Beilstein Handbook Reference)
18272-07-6

[Structure]
BRN 0497234,LS-117103,1-(1H-Indol-3-yloxoacetyl)-4-phenyl-4-piperidino

[ Properties Computed from Structure]
Molecular Weight348.3951 [g/mol]
Molecular FormulaC21H20N2O3
XLogP2.6
H-Bond Donor2
H-Bond Acceptor4
Rotatable Bond Count3
Tautomer Count3
Exact Mass348.147393
MonoIsotopic Mass348.147393
Topological Polar Surface Area73.4
Heavy Atom Count26
Formal Charge0
Complexity535
Isotope Atom Count0
Defined Atom StereoCenter Count0
Undefined Atom StereoCenter Count0
Defined Bond StereoCenter Count0
Undefined Bond StereoCenter Count0
Covalently-Bonded Unit Count1

[ Descriptors Computed from Structure]
IUPAC Name: 1-(4-hydroxy-4-phenylpiperidin-1-yl)-2-(1H-indol-3-yl)ethane-1,2-dione
Canonical SMILES: C1CN(CCC1(C2=CC=CC=C2)O)C(=O)C(=O)C3=CNC4=CC=CC=C43
InChI: InChI=1/C21H20N2O3/c24-19(17-14-22-18-9-5-4-8-16(17)18)20(25)23-12-10-21
(26,11-13-23)15-6-2-1-3-7-15/h1-9,14,22,26H,10-13H2

 
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