OGY

[2-(3-phenylpropyl)-1H-imidazol-4-yl]methanol

Created: 2019-06-24
Last modified:  2019-12-11

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Chemical Details

Formal Charge0
Atom Count32
Chiral Atom Count0
Bond Count33
Aromatic Bond Count11
2D diagram of OGY

Chemical Component Summary

Name[2-(3-phenylpropyl)-1H-imidazol-4-yl]methanol
Systematic Name (OpenEye OEToolkits)[2-(3-phenylpropyl)-1~{H}-imidazol-4-yl]methanol
FormulaC13 H16 N2 O
Molecular Weight216.279
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs12.01c1(ccccc1)CCCc2ncc(CO)n2
SMILESCACTVS3.385OCc1c[nH]c(CCCc2ccccc2)n1
SMILESOpenEye OEToolkits2.0.7c1ccc(cc1)CCCc2[nH]cc(n2)CO
Canonical SMILESCACTVS3.385 OCc1c[nH]c(CCCc2ccccc2)n1
Canonical SMILESOpenEye OEToolkits2.0.7 c1ccc(cc1)CCCc2[nH]cc(n2)CO
InChIInChI1.03 InChI=1S/C13H16N2O/c16-10-12-9-14-13(15-12)8-4-7-11-5-2-1-3-6-11/h1-3,5-6,9,16H,4,7-8,10H2,(H,14,15)
InChIKeyInChI1.03 YJBVUMXRLPWRCM-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 145704656