OZM

(6-benzyl-1-benzofuran-3-yl)acetic acid

Created:	2019-07-22
Last modified:	2019-12-25

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1 entries where OZM is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	34
Chiral Atom Count	0
Bond Count	36
Aromatic Bond Count	16

2D diagram of OZM

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Chemical Component Summary
Name	(6-benzyl-1-benzofuran-3-yl)acetic acid
Systematic Name (OpenEye OEToolkits)	2-[6-(phenylmethyl)-1-benzofuran-3-yl]ethanoic acid
Formula	C₁₇ H₁₄ O₃
Molecular Weight	266.291
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	C(c1ccc2c(CC(O)=O)coc2c1)c3ccccc3
SMILES	CACTVS	3.385	OC(=O)Cc1coc2cc(Cc3ccccc3)ccc12
SMILES	OpenEye OEToolkits	2.0.7	c1ccc(cc1)Cc2ccc3c(c2)occ3CC(=O)O
Canonical SMILES	CACTVS	3.385	OC(=O)Cc1coc2cc(Cc3ccccc3)ccc12
Canonical SMILES	OpenEye OEToolkits	2.0.7	c1ccc(cc1)Cc2ccc3c(c2)occ3CC(=O)O
InChI	InChI	1.03	InChI=1S/C17H14O3/c18-17(19)10-14-11-20-16-9-13(6-7-15(14)16)8-12-4-2-1-3-5-12/h1-7,9,11H,8,10H2,(H,18,19)
InChIKey	InChI	1.03	NANLKTVMZIVCBJ-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	145714267

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