2NW

3-bromoquinolin-4-amine

Created:	2013-12-11
Last modified:	2013-12-25

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1 entries where 2NW is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	19
Chiral Atom Count	0
Bond Count	20
Aromatic Bond Count	11

2D diagram of 2NW

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Chemical Component Summary
Name	3-bromoquinolin-4-amine
Systematic Name (OpenEye OEToolkits)	3-bromanylquinolin-4-amine
Formula	C₉ H₇ Br N₂
Molecular Weight	223.069
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	Brc1c(c2ccccc2nc1)N
SMILES	CACTVS	3.385	Nc1c(Br)cnc2ccccc12
SMILES	OpenEye OEToolkits	1.7.6	c1ccc2c(c1)c(c(cn2)Br)N
Canonical SMILES	CACTVS	3.385	Nc1c(Br)cnc2ccccc12
Canonical SMILES	OpenEye OEToolkits	1.7.6	c1ccc2c(c1)c(c(cn2)Br)N
InChI	InChI	1.03	InChI=1S/C9H7BrN2/c10-7-5-12-8-4-2-1-3-6(8)9(7)11/h1-5H,(H2,11,12)
InChIKey	InChI	1.03	TYGUEEGQSYNEHB-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	817331

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