WXZ

(1R)-7-(4-chlorophenyl)-1,2,3,4-tetrahydronaphthalene-1-carboxylic acid

Created:	2023-05-23
Last modified:	2023-06-14

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1 entries where WXZ is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	35
Chiral Atom Count	1
Bond Count	37
Aromatic Bond Count	12

2D diagram of WXZ

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Chemical Component Summary
Name	(1R)-7-(4-chlorophenyl)-1,2,3,4-tetrahydronaphthalene-1-carboxylic acid
Systematic Name (OpenEye OEToolkits)	(1~{R})-7-(4-chlorophenyl)-1,2,3,4-tetrahydronaphthalene-1-carboxylic acid
Formula	C₁₇ H₁₅ Cl O₂
Molecular Weight	286.753
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	12.01	Clc1ccc(cc1)c1ccc2CCCC(c2c1)C(=O)O
SMILES	CACTVS	3.385	OC(=O)[CH]1CCCc2ccc(cc12)c3ccc(Cl)cc3
SMILES	OpenEye OEToolkits	2.0.7	c1cc(ccc1c2ccc3c(c2)C(CCC3)C(=O)O)Cl
Canonical SMILES	CACTVS	3.385	OC(=O)[C@@H]1CCCc2ccc(cc12)c3ccc(Cl)cc3
Canonical SMILES	OpenEye OEToolkits	2.0.7	c1cc(ccc1c2ccc3c(c2)[C@@H](CCC3)C(=O)O)Cl
InChI	InChI	1.06	InChI=1S/C17H15ClO2/c18-14-8-6-11(7-9-14)13-5-4-12-2-1-3-15(17(19)20)16(12)10-13/h4-10,15H,1-3H2,(H,19,20)/t15-/m1/s1
InChIKey	InChI	1.06	HMSUYCUFTVOQJG-OAHLLOKOSA-N

Related Resource References

Resource Name	Reference
PubChem	168451731

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