J8F

4-[(~{Z})-1-cyano-2-[4-[2-hydroxyethyl(methyl)amino]phenyl]ethenyl]benzenecarbonitrile

Created:	2021-04-23
Last modified:	2021-11-24

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5 entries where J8F is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	40
Chiral Atom Count	0
Bond Count	41
Aromatic Bond Count	12

2D diagram of J8F

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Chemical Component Summary
Name	4-[(~{Z})-1-cyano-2-[4-[2-hydroxyethyl(methyl)amino]phenyl]ethenyl]benzenecarbonitrile
Systematic Name (OpenEye OEToolkits)	4-[(~{Z})-1-cyano-2-[4-[2-hydroxyethyl(methyl)amino]phenyl]ethenyl]benzenecarbonitrile
Formula	C₁₉ H₁₇ N₃ O
Molecular Weight	303.358
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	CN(CCO)c1ccc(cc1)C=C(C#N)c2ccc(cc2)C#N
SMILES	OpenEye OEToolkits	2.0.7	CN(CCO)c1ccc(cc1)C=C(C#N)c2ccc(cc2)C#N
Canonical SMILES	CACTVS	3.385	CN(CCO)c1ccc(cc1)\C=C(C#N)\c2ccc(cc2)C#N
Canonical SMILES	OpenEye OEToolkits	2.0.7	CN(CCO)c1ccc(cc1)/C=C(\C#N)/c2ccc(cc2)C#N
InChI	InChI	1.03	InChI=1S/C19H17N3O/c1-22(10-11-23)19-8-4-15(5-9-19)12-18(14-21)17-6-2-16(13-20)3-7-17/h2-9,12,23H,10-11H2,1H3/b18-12+
InChIKey	InChI	1.03	DIAVZHWDYXQAFC-LDADJPATSA-N

Related Resource References

Resource Name	Reference
PubChem	154828692

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