ZGB

3-(4-methoxy-3-methylphenyl)propanoic acid

Created:	2010-11-15
Last modified:	2011-06-04

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2 entries where ZGB is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	28
Chiral Atom Count	0
Bond Count	28
Aromatic Bond Count	6

2D diagram of ZGB

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Chemical Component Summary
Name	3-(4-methoxy-3-methylphenyl)propanoic acid
Systematic Name (OpenEye OEToolkits)	3-(4-methoxy-3-methyl-phenyl)propanoic acid
Formula	C₁₁ H₁₄ O₃
Molecular Weight	194.227
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	O=C(O)CCc1ccc(OC)c(c1)C
SMILES	CACTVS	3.370	COc1ccc(CCC(O)=O)cc1C
SMILES	OpenEye OEToolkits	1.7.0	Cc1cc(ccc1OC)CCC(=O)O
Canonical SMILES	CACTVS	3.370	COc1ccc(CCC(O)=O)cc1C
Canonical SMILES	OpenEye OEToolkits	1.7.0	Cc1cc(ccc1OC)CCC(=O)O
InChI	InChI	1.03	InChI=1S/C11H14O3/c1-8-7-9(4-6-11(12)13)3-5-10(8)14-2/h3,5,7H,4,6H2,1-2H3,(H,12,13)
InChIKey	InChI	1.03	ZATPJYSLVGVGGY-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	5237641

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