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201

Summary
Name:3-AMIDO-5-BIPHENYL-BENZOIC ACID
Synonyms:5-(AMINOCARBONYL)-1,1':4',1''-TERPHENYL-3-CARBOXYLIC ACID
Formula:C20 H15 N O3
Formal charge:0
Formula weight:317.338 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.045-carbamoyl-1,1':4',1''-terphenyl-3-carboxylic acid
OpenEye OEToolkits1.5.03-aminocarbonyl-5-(4-phenylphenyl)benzoic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C(c3cc(c2ccc(c1ccccc1)cc2)cc(c3)C(=O)O)N
SMILES_CANONICALCACTVS3.341NC(=O)c1cc(cc(c1)c2ccc(cc2)c3ccccc3)C(O)=O
SMILESCACTVS3.341NC(=O)c1cc(cc(c1)c2ccc(cc2)c3ccccc3)C(O)=O
SMILES_CANONICALOpenEye OEToolkits1.5.0c1ccc(cc1)c2ccc(cc2)c3cc(cc(c3)C(=O)O)C(=O)N
SMILESOpenEye OEToolkits1.5.0c1ccc(cc1)c2ccc(cc2)c3cc(cc(c3)C(=O)O)C(=O)N
InChIInChI1.03InChI=1S/C20H15NO3/c21-19(22)17-10-16(11-18(12-17)20(23)24)15-8-6-14(7-9-15)13-4-2-1-3-5-13/h1-12H,(H2,21,22)(H,23,24)
InChIKeyInChI1.03LAZPCGBRHLARSI-UHFFFAOYSA-N

218853

PDB entries from 2024-04-24

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