UXG

1-(diphenylmethyl)azetidin-3-ol

Created:2020-06-03
Last modified:  2020-06-17

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Chemical Details

Formal Charge0
Atom Count35
Chiral Atom Count0
Bond Count37
Aromatic Bond Count12
2D diagram of UXG

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Chemical Component Summary

Name1-(diphenylmethyl)azetidin-3-ol
Systematic Name (OpenEye OEToolkits)1-(diphenylmethyl)azetidin-3-ol
FormulaC16 H17 N O
Molecular Weight239.312
TypeNON-POLYMER

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01c1(ccccc1)C(c2ccccc2)N3CC(C3)O
SMILESCACTVS3.385OC1CN(C1)C(c2ccccc2)c3ccccc3
SMILESOpenEye OEToolkits2.0.7c1ccc(cc1)C(c2ccccc2)N3CC(C3)O
Canonical SMILESCACTVS3.385 OC1CN(C1)C(c2ccccc2)c3ccccc3
Canonical SMILESOpenEye OEToolkits2.0.7 c1ccc(cc1)C(c2ccccc2)N3CC(C3)O
InChIInChI1.03 InChI=1S/C16H17NO/c18-15-11-17(12-15)16(13-7-3-1-4-8-13)14-9-5-2-6-10-14/h1-10,15-16,18H,11-12H2
InChIKeyInChI1.03 MMAJXKGUZYDTHV-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 330448
ChEMBL CHEMBL3763552
CCDC/CSD DPMAZO10