KJ1

N-(8-amino-8-oxooctyl)nonanamide

Created:	2018-12-10
Last modified:	2019-11-20

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1 entries where KJ1 is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	55
Chiral Atom Count	0
Bond Count	54
Aromatic Bond Count	0

2D diagram of KJ1

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Chemical Component Summary
Name	N-(8-amino-8-oxooctyl)nonanamide
Systematic Name (OpenEye OEToolkits)	~{N}-(8-azanyl-8-oxidanylidene-octyl)nonanamide
Formula	C₁₇ H₃₄ N₂ O₂
Molecular Weight	298.464
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	C(CNC(CCCCCCCC)=O)CCCCCC(=O)N
SMILES	CACTVS	3.385	CCCCCCCCC(=O)NCCCCCCCC(N)=O
SMILES	OpenEye OEToolkits	2.0.6	CCCCCCCCC(=O)NCCCCCCCC(=O)N
Canonical SMILES	CACTVS	3.385	CCCCCCCCC(=O)NCCCCCCCC(N)=O
Canonical SMILES	OpenEye OEToolkits	2.0.6	CCCCCCCCC(=O)NCCCCCCCC(=O)N
InChI	InChI	1.03	InChI=1S/C17H34N2O2/c1-2-3-4-5-8-11-14-17(21)19-15-12-9-6-7-10-13-16(18)20/h2-15H2,1H3,(H2,18,20)(H,19,21)
InChIKey	InChI	1.03	SKOHWEXHBDBESR-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	73897830

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