VLG

3'-methoxy[1,1'-biphenyl]-4-carboxylic acid

Created:	2020-08-27
Last modified:	2022-03-09

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1 entries where VLG is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	29
Chiral Atom Count	0
Bond Count	30
Aromatic Bond Count	12

2D diagram of VLG

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Chemical Component Summary
Name	3'-methoxy[1,1'-biphenyl]-4-carboxylic acid
Synonyms	4-(3'-methoxyphenyl)benzoic acid
Systematic Name (OpenEye OEToolkits)	4-(3-methoxyphenyl)benzoic acid
Formula	C₁₄ H₁₂ O₃
Molecular Weight	228.243
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	COc1cccc(c1)c2ccc(cc2)C(O)=O
SMILES	CACTVS	3.385	COc1cccc(c1)c2ccc(cc2)C(O)=O
SMILES	OpenEye OEToolkits	2.0.7	COc1cccc(c1)c2ccc(cc2)C(=O)O
Canonical SMILES	CACTVS	3.385	COc1cccc(c1)c2ccc(cc2)C(O)=O
Canonical SMILES	OpenEye OEToolkits	2.0.7	COc1cccc(c1)c2ccc(cc2)C(=O)O
InChI	InChI	1.03	InChI=1S/C14H12O3/c1-17-13-4-2-3-12(9-13)10-5-7-11(8-6-10)14(15)16/h2-9H,1H3,(H,15,16)
InChIKey	InChI	1.03	OAMJQKDGQYAQKD-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	2759551
ChEMBL	CHEMBL4588996

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