B0V

2-methoxy-~{N}-(2,4,6-trimethylphenyl)ethanamide

Created:	2017-07-28
Last modified:	2018-08-08

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4 entries where B0V is found as a standalone ligand

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

2D diagram of B0V

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Chemical Component Summary
Name	2-methoxy-~{N}-(2,4,6-trimethylphenyl)ethanamide
Systematic Name (OpenEye OEToolkits)	2-methoxy-~{N}-(2,4,6-trimethylphenyl)ethanamide
Formula	C₁₂ H₁₇ N O₂
Molecular Weight	207.269
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	COCC(=O)Nc1c(C)cc(C)cc1C
SMILES	OpenEye OEToolkits	2.0.6	Cc1cc(c(c(c1)C)NC(=O)COC)C
Canonical SMILES	CACTVS	3.385	COCC(=O)Nc1c(C)cc(C)cc1C
Canonical SMILES	OpenEye OEToolkits	2.0.6	Cc1cc(c(c(c1)C)NC(=O)COC)C
InChI	InChI	1.03	InChI=1S/C12H17NO2/c1-8-5-9(2)12(10(3)6-8)13-11(14)7-15-4/h5-6H,7H2,1-4H3,(H,13,14)
InChIKey	InChI	1.03	XZMRSYKEMFCZKR-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	836500

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