1BZ

6-benzyl-1-hydroxy-4-methylpyridin-2(1H)-one

Created:	2012-11-29
Last modified:	2013-05-22

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1 entries where 1BZ is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	29
Chiral Atom Count	0
Bond Count	30
Aromatic Bond Count	6

2D diagram of 1BZ

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Chemical Component Summary
Name	6-benzyl-1-hydroxy-4-methylpyridin-2(1H)-one
Systematic Name (OpenEye OEToolkits)	4-methyl-1-oxidanyl-6-(phenylmethyl)pyridin-2-one
Formula	C₁₃ H₁₃ N O₂
Molecular Weight	215.248
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O=C1C=C(C=C(N1O)Cc2ccccc2)C
SMILES	CACTVS	3.370	CC1=CC(=O)N(O)C(=C1)Cc2ccccc2
SMILES	OpenEye OEToolkits	1.7.6	CC1=CC(=O)N(C(=C1)Cc2ccccc2)O
Canonical SMILES	CACTVS	3.370	CC1=CC(=O)N(O)C(=C1)Cc2ccccc2
Canonical SMILES	OpenEye OEToolkits	1.7.6	CC1=CC(=O)N(C(=C1)Cc2ccccc2)O
InChI	InChI	1.03	InChI=1S/C13H13NO2/c1-10-7-12(14(16)13(15)8-10)9-11-5-3-2-4-6-11/h2-8,16H,9H2,1H3
InChIKey	InChI	1.03	AVLZAVSZOAQKRC-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
Pharos	CHEMBL2386126
PubChem	13590964
ChEMBL	CHEMBL2386126

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