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NSC177968,AIDS127722,AIDS-127722,NSC 177968,(1-(Methoxymethyl)-1H-indo

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摘 要:NSC177968,AIDS127722,AIDS-127722,NSC 177968,(1-(Methoxymethyl)-1H-indol-2-yl)(4-methoxyphenyl)methanone,40899-81-8, [1-(methoxymethyl)indol-2-yl]-(4-methoxyphenyl)methanone,Canonical SMILES: COCN1C2=CC=CC=C2C=C1C(=O)C3=CC=C(C=C3)OC,InChI: InChI=1/C18
[Synonyms]
NSC177968
AIDS127722
AIDS-127722
NSC 177968
(1-(Methoxymethyl)-1H-indol-2-yl)(4-methoxyphenyl)methanone
40899-81-8

[Structure]
NSC177968,AIDS127722,AIDS-127722,NSC 177968,(1-(Methoxymethyl)-1H-indo

[ Properties Computed from Structure]
Molecular Weight295.33248 [g/mol]
Molecular FormulaC18H17NO3
XLogP3.9
H-Bond Donor0
H-Bond Acceptor4
Rotatable Bond Count5
Exact Mass295.120843
MonoIsotopic Mass295.120843
Topological Polar Surface Area40.5
Heavy Atom Count22
Formal Charge0
Complexity379
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-(methoxymethyl)indol-2-yl]-(4-methoxyphenyl)methanone
Canonical SMILES: COCN1C2=CC=CC=C2C=C1C(=O)C3=CC=C(C=C3)OC
InChI: InChI=1/C18H17NO3/c1-21-12-19-16-6-4-3-5-14(16)11-17(19)18(20)13-7-9-15
(22-2)10-8-13/h3-11H,12H2,1-2H3

 
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