2ZT

2-[(quinolin-7-yloxy)methyl]quinoline

Created: 2013-09-20
Last modified:  2014-05-14

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Chemical Details

Formal Charge0
Atom Count36
Chiral Atom Count0
Bond Count39
Aromatic Bond Count22
2D diagram of 2ZT

Chemical Component Summary

Name2-[(quinolin-7-yloxy)methyl]quinoline
Systematic Name (OpenEye OEToolkits)2-(quinolin-7-yloxymethyl)quinoline
FormulaC19 H14 N2 O
Molecular Weight286.327
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs12.01n4c3cc(OCc1nc2ccccc2cc1)ccc3ccc4
SMILESCACTVS3.385C(Oc1ccc2cccnc2c1)c3ccc4ccccc4n3
SMILESOpenEye OEToolkits1.7.6c1ccc2c(c1)ccc(n2)COc3ccc4cccnc4c3
Canonical SMILESCACTVS3.385 C(Oc1ccc2cccnc2c1)c3ccc4ccccc4n3
Canonical SMILESOpenEye OEToolkits1.7.6 c1ccc2c(c1)ccc(n2)COc3ccc4cccnc4c3
InChIInChI1.03 InChI=1S/C19H14N2O/c1-2-6-18-14(4-1)7-9-16(21-18)13-22-17-10-8-15-5-3-11-20-19(15)12-17/h1-12H,13H2
InChIKeyInChI1.03 XVPLFTQUQMWPKC-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 73659152