H1A

2-ethyl-N-(2-hydroxyphenyl)butanamide

Created:	2018-06-08
Last modified:	2019-03-27

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2 entries where H1A 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 H1A

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Chemical Component Summary
Name	2-ethyl-N-(2-hydroxyphenyl)butanamide
Systematic Name (OpenEye OEToolkits)	2-ethyl-~{N}-(2-hydroxyphenyl)butanamide
Formula	C₁₂ H₁₇ N O₂
Molecular Weight	207.269
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	N(C(C(CC)CC)=O)c1c(cccc1)O
SMILES	CACTVS	3.385	CCC(CC)C(=O)Nc1ccccc1O
SMILES	OpenEye OEToolkits	2.0.6	CCC(CC)C(=O)Nc1ccccc1O
Canonical SMILES	CACTVS	3.385	CCC(CC)C(=O)Nc1ccccc1O
Canonical SMILES	OpenEye OEToolkits	2.0.6	CCC(CC)C(=O)Nc1ccccc1O
InChI	InChI	1.03	InChI=1S/C12H17NO2/c1-3-9(4-2)12(15)13-10-7-5-6-8-11(10)14/h5-9,14H,3-4H2,1-2H3,(H,13,15)
InChIKey	InChI	1.03	ZHIXKMXOQAKAKN-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	836763

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