WXN

3-(((2-cycloheptylethyl)(methyl)amino)methyl)-N-methyl-1H-indol-7-amine

Created:	2023-10-17
Last modified:	2024-10-23

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1 entries where WXN is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	54
Chiral Atom Count	0
Bond Count	56
Aromatic Bond Count	10

2D diagram of WXN

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Chemical Component Summary
Name	3-(((2-cycloheptylethyl)(methyl)amino)methyl)-N-methyl-1H-indol-7-amine
Synonyms	3-[[2-cycloheptylethyl(methyl)amino]methyl]-N-methyl-1H-indol-7-amine
Systematic Name (OpenEye OEToolkits)	3-[[2-cycloheptylethyl(methyl)amino]methyl]-~{N}-methyl-1~{H}-indol-7-amine
Formula	C₂₀ H₃₁ N₃
Molecular Weight	313.48
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	CNc1cccc2c(CN(C)CCC3CCCCCC3)c[nH]c12
SMILES	OpenEye OEToolkits	2.0.7	CNc1cccc2c1[nH]cc2CN(C)CCC3CCCCCC3
Canonical SMILES	CACTVS	3.385	CNc1cccc2c(CN(C)CCC3CCCCCC3)c[nH]c12
Canonical SMILES	OpenEye OEToolkits	2.0.7	CNc1cccc2c1[nH]cc2CN(C)CCC3CCCCCC3
InChI	InChI	1.06	InChI=1S/C20H31N3/c1-21-19-11-7-10-18-17(14-22-20(18)19)15-23(2)13-12-16-8-5-3-4-6-9-16/h7,10-11,14,16,21-22H,3-6,8-9,12-13,15H2,1-2H3
InChIKey	InChI	1.06	BPPWCTYSUCXUIN-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	172055171

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