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BNA

Summary
Name:BIS-(NAPHTHYL-1-METHYL) ACETIC ACID
Formula:C24 H20 O2
Formal charge:0
Formula weight:340.414 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.043-naphthalen-1-yl-2-(naphthalen-1-ylmethyl)propanoic acid
OpenEye OEToolkits1.5.03-naphthalen-1-yl-2-(naphthalen-1-ylmethyl)propanoic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C(O)C(Cc2c1ccccc1ccc2)Cc4cccc3ccccc34
SMILES_CANONICALCACTVS3.341OC(=O)C(Cc1cccc2ccccc12)Cc3cccc4ccccc34
SMILESCACTVS3.341OC(=O)C(Cc1cccc2ccccc12)Cc3cccc4ccccc34
SMILES_CANONICALOpenEye OEToolkits1.5.0c1ccc2c(c1)cccc2CC(Cc3cccc4c3cccc4)C(=O)O
SMILESOpenEye OEToolkits1.5.0c1ccc2c(c1)cccc2CC(Cc3cccc4c3cccc4)C(=O)O
InChIInChI1.03InChI=1S/C24H20O2/c25-24(26)21(15-19-11-5-9-17-7-1-3-13-22(17)19)16-20-12-6-10-18-8-2-4-14-23(18)20/h1-14,21H,15-16H2,(H,25,26)
InChIKeyInChI1.03RMTCEQSLPGEKAH-UHFFFAOYSA-N

223532

건을2024-08-07부터공개중

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