FJ8

~{N}-[(~{E})-(4-methylphenyl)methylideneamino]-2-(2~{H}-1,2,3,4-tetrazol-5-yl)ethanamide

Created:	2018-07-10
Last modified:	2020-01-29

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1 entries where FJ8 is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	30
Chiral Atom Count	0
Bond Count	31
Aromatic Bond Count	11

2D diagram of FJ8

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Chemical Component Summary
Name	~{N}-[(~{E})-(4-methylphenyl)methylideneamino]-2-(2~{H}-1,2,3,4-tetrazol-5-yl)ethanamide
Systematic Name (OpenEye OEToolkits)	~{N}-[(~{E})-(4-methylphenyl)methylideneamino]-2-(2~{H}-1,2,3,4-tetrazol-5-yl)ethanamide
Formula	C₁₁ H₁₂ N₆ O
Molecular Weight	244.253
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	Cc1ccc(cc1)C=NNC(=O)Cc2n[nH]nn2
SMILES	OpenEye OEToolkits	2.0.6	Cc1ccc(cc1)C=NNC(=O)Cc2n[nH]nn2
Canonical SMILES	CACTVS	3.385	Cc1ccc(cc1)/C=N/NC(=O)Cc2n[nH]nn2
Canonical SMILES	OpenEye OEToolkits	2.0.6	Cc1ccc(cc1)/C=N/NC(=O)Cc2n[nH]nn2
InChI	InChI	1.03	InChI=1S/C11H12N6O/c1-8-2-4-9(5-3-8)7-12-15-11(18)6-10-13-16-17-14-10/h2-5,7H,6H2,1H3,(H,15,18)(H,13,14,16,17)/b12-7+
InChIKey	InChI	1.03	CVRGHXWTBXFGAR-KPKJPENVSA-N

Related Resource References

Resource Name	Reference
PubChem	145945994

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