WZL

7-bromanyl-3-(phenylmethyl)-1~{H}-benzimidazol-2-one

Created: 2023-10-17
Last modified:  2024-03-27

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Chemical Details

Formal Charge0
Atom Count29
Chiral Atom Count0
Bond Count31
Aromatic Bond Count12
2D diagram of WZL

Chemical Component Summary

Name7-bromanyl-3-(phenylmethyl)-1~{H}-benzimidazol-2-one
Systematic Name (OpenEye OEToolkits)7-bromanyl-3-(phenylmethyl)-1~{H}-benzimidazol-2-one
FormulaC14 H11 Br N2 O
Molecular Weight303.154
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESCACTVS3.385Brc1cccc2N(Cc3ccccc3)C(=O)Nc12
SMILESOpenEye OEToolkits2.0.7c1ccc(cc1)CN2c3cccc(c3NC2=O)Br
Canonical SMILESCACTVS3.385 Brc1cccc2N(Cc3ccccc3)C(=O)Nc12
Canonical SMILESOpenEye OEToolkits2.0.7 c1ccc(cc1)CN2c3cccc(c3NC2=O)Br
InChIInChI1.06 InChI=1S/C14H11BrN2O/c15-11-7-4-8-12-13(11)16-14(18)17(12)9-10-5-2-1-3-6-10/h1-8H,9H2,(H,16,18)
InChIKeyInChI1.06 DXQIMXWTZLDPOP-UHFFFAOYSA-N

Related Resource References

Resource NameReference
PubChem 69259305