VZE

5-[[octyl-[[4-(2-oxidanylphenoxy)phenyl]methyl]amino]methyl]-2-phenoxy-phenol

Created:	2023-04-21
Last modified:	2024-01-24

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1 entries where VZE is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	78
Chiral Atom Count	0
Bond Count	81
Aromatic Bond Count	24

2D diagram of VZE

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Chemical Component Summary
Name	5-[[octyl-[[4-(2-oxidanylphenoxy)phenyl]methyl]amino]methyl]-2-phenoxy-phenol
Systematic Name (OpenEye OEToolkits)	5-[[octyl-[[4-(2-oxidanylphenoxy)phenyl]methyl]amino]methyl]-2-phenoxy-phenol
Formula	C₃₄ H₃₉ N O₄
Molecular Weight	525.678
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	CCCCCCCCN(Cc1ccc(Oc2ccccc2O)cc1)Cc3ccc(Oc4ccccc4)c(O)c3
SMILES	OpenEye OEToolkits	2.0.7	CCCCCCCCN(Cc1ccc(cc1)Oc2ccccc2O)Cc3ccc(c(c3)O)Oc4ccccc4
Canonical SMILES	CACTVS	3.385	CCCCCCCCN(Cc1ccc(Oc2ccccc2O)cc1)Cc3ccc(Oc4ccccc4)c(O)c3
Canonical SMILES	OpenEye OEToolkits	2.0.7	CCCCCCCCN(Cc1ccc(cc1)Oc2ccccc2O)Cc3ccc(c(c3)O)Oc4ccccc4
InChI	InChI	1.06	InChI=1S/C34H39NO4/c1-2-3-4-5-6-12-23-35(25-27-17-20-30(21-18-27)39-33-16-11-10-15-31(33)36)26-28-19-22-34(32(37)24-28)38-29-13-8-7-9-14-29/h7-11,13-22,24,36-37H,2-6,12,23,25-26H2,1H3
InChIKey	InChI	1.06	LSXDYGAOQCUIBL-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	169552812

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