AFK

[3-chloranyl-4-(2-methoxy-5-methyl-phenyl)phenyl]methanamine

Created:	2017-08-18
Last modified:	2018-09-05

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1 entries where AFK is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	34
Chiral Atom Count	0
Bond Count	35
Aromatic Bond Count	12

2D diagram of AFK

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Chemical Component Summary
Name	[3-chloranyl-4-(2-methoxy-5-methyl-phenyl)phenyl]methanamine
Systematic Name (OpenEye OEToolkits)	[3-chloranyl-4-(2-methoxy-5-methyl-phenyl)phenyl]methanamine
Formula	C₁₅ H₁₆ Cl N O
Molecular Weight	261.747
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	COc1ccc(C)cc1c2ccc(CN)cc2Cl
SMILES	OpenEye OEToolkits	2.0.6	Cc1ccc(c(c1)c2ccc(cc2Cl)CN)OC
Canonical SMILES	CACTVS	3.385	COc1ccc(C)cc1c2ccc(CN)cc2Cl
Canonical SMILES	OpenEye OEToolkits	2.0.6	Cc1ccc(c(c1)c2ccc(cc2Cl)CN)OC
InChI	InChI	1.03	InChI=1S/C15H16ClNO/c1-10-3-6-15(18-2)13(7-10)12-5-4-11(9-17)8-14(12)16/h3-8H,9,17H2,1-2H3
InChIKey	InChI	1.03	FAUPJNHBQZGWOE-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	108393637

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