P1F

2-(2-azanylphenoxy)-5-hexyl-phenol

Created:	2013-05-15
Last modified:	2014-09-05

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1 entries where P1F is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	44
Chiral Atom Count	0
Bond Count	45
Aromatic Bond Count	12

2D diagram of P1F

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Chemical Component Summary
Name	2-(2-azanylphenoxy)-5-hexyl-phenol
Systematic Name (OpenEye OEToolkits)	2-(2-azanylphenoxy)-5-hexyl-phenol
Formula	C₁₈ H₂₃ N O₂
Molecular Weight	285.381
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O(c1c(N)cccc1)c2ccc(cc2O)CCCCCC
SMILES	CACTVS	3.385	CCCCCCc1ccc(Oc2ccccc2N)c(O)c1
SMILES	OpenEye OEToolkits	1.9.2	CCCCCCc1ccc(c(c1)O)Oc2ccccc2N
Canonical SMILES	CACTVS	3.385	CCCCCCc1ccc(Oc2ccccc2N)c(O)c1
Canonical SMILES	OpenEye OEToolkits	1.9.2	CCCCCCc1ccc(c(c1)O)Oc2ccccc2N
InChI	InChI	1.03	InChI=1S/C18H23NO2/c1-2-3-4-5-8-14-11-12-18(16(20)13-14)21-17-10-7-6-9-15(17)19/h6-7,9-13,20H,2-5,8,19H2,1H3
InChIKey	InChI	1.03	UGZFBZMADDXZRA-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	44450094
ChEMBL	CHEMBL264434

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