ZZW

9-(4-fluorobenzyl)-N-hydroxy-9H-beta-carboline-3-carboxamide

Created:	2010-10-04
Last modified:	2011-06-04

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1 entries where ZZW is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	39
Chiral Atom Count	0
Bond Count	42
Aromatic Bond Count	21

2D diagram of ZZW

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Chemical Component Summary
Name	9-(4-fluorobenzyl)-N-hydroxy-9H-beta-carboline-3-carboxamide
Systematic Name (OpenEye OEToolkits)	9-[(4-fluorophenyl)methyl]-N-hydroxy-pyrido[3,4-b]indole-3-carboxamide
Formula	C₁₉ H₁₄ F N₃ O₂
Molecular Weight	335.332
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	Fc1ccc(cc1)Cn3c4c(c2cc(ncc23)C(=O)NO)cccc4
SMILES	CACTVS	3.370	ONC(=O)c1cc2c(cn1)n(Cc3ccc(F)cc3)c4ccccc24
SMILES	OpenEye OEToolkits	1.7.0	c1ccc2c(c1)c3cc(ncc3n2Cc4ccc(cc4)F)C(=O)NO
Canonical SMILES	CACTVS	3.370	ONC(=O)c1cc2c(cn1)n(Cc3ccc(F)cc3)c4ccccc24
Canonical SMILES	OpenEye OEToolkits	1.7.0	c1ccc2c(c1)c3cc(ncc3n2Cc4ccc(cc4)F)C(=O)NO
InChI	InChI	1.03	InChI=1S/C19H14FN3O2/c20-13-7-5-12(6-8-13)11-23-17-4-2-1-3-14(17)15-9-16(19(24)22-25)21-10-18(15)23/h1-10,25H,11H2,(H,22,24)
InChIKey	InChI	1.03	ADHFMENDOUEJRK-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	3013459

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