NW4

3-cyclohexyl-1-(morpholin-4-yl)propan-1-one

Created:	2019-05-28
Last modified:	2019-08-07

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3 entries where NW4 is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	39
Chiral Atom Count	0
Bond Count	40
Aromatic Bond Count	0

2D diagram of NW4

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Chemical Component Summary
Name	3-cyclohexyl-1-(morpholin-4-yl)propan-1-one
Systematic Name (OpenEye OEToolkits)	3-cyclohexyl-1-morpholin-4-yl-propan-1-one
Formula	C₁₃ H₂₃ N O₂
Molecular Weight	225.327
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	N1(CCOCC1)C(=O)CCC2CCCCC2
SMILES	CACTVS	3.385	O=C(CCC1CCCCC1)N2CCOCC2
SMILES	OpenEye OEToolkits	2.0.6	C1CCC(CC1)CCC(=O)N2CCOCC2
Canonical SMILES	CACTVS	3.385	O=C(CCC1CCCCC1)N2CCOCC2
Canonical SMILES	OpenEye OEToolkits	2.0.6	C1CCC(CC1)CCC(=O)N2CCOCC2
InChI	InChI	1.03	InChI=1S/C13H23NO2/c15-13(14-8-10-16-11-9-14)7-6-12-4-2-1-3-5-12/h12H,1-11H2
InChIKey	InChI	1.03	KUIOCGNNDZSGKS-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	887288

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