QCW

~{N}-methyl-2-oxidanylidene-1-(phenylmethyl)pyridine-3-carboxamide

Created:	2020-06-08
Last modified:	2020-08-05

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1 entries where QCW is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	32
Chiral Atom Count	0
Bond Count	33
Aromatic Bond Count	6

2D diagram of QCW

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Chemical Component Summary
Name	~{N}-methyl-2-oxidanylidene-1-(phenylmethyl)pyridine-3-carboxamide
Systematic Name (OpenEye OEToolkits)	~{N}-methyl-2-oxidanylidene-1-(phenylmethyl)pyridine-3-carboxamide
Formula	C₁₄ H₁₄ N₂ O₂
Molecular Weight	242.273
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	CNC(=O)C1=CC=CN(Cc2ccccc2)C1=O
SMILES	OpenEye OEToolkits	2.0.7	CNC(=O)C1=CC=CN(C1=O)Cc2ccccc2
Canonical SMILES	CACTVS	3.385	CNC(=O)C1=CC=CN(Cc2ccccc2)C1=O
Canonical SMILES	OpenEye OEToolkits	2.0.7	CNC(=O)C1=CC=CN(C1=O)Cc2ccccc2
InChI	InChI	1.03	InChI=1S/C14H14N2O2/c1-15-13(17)12-8-5-9-16(14(12)18)10-11-6-3-2-4-7-11/h2-9H,10H2,1H3,(H,15,17)
InChIKey	InChI	1.03	FPNFBPWMDHIOEK-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	48157449

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