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ANN

Summary
Name:4-METHOXYBENZOIC ACID
Synonyms:P-ANISIC ACID
Formula:C8 H8 O3
Formal charge:0
Formula weight:152.147 Da
Component type:NON-POLYMER

Chemical Identifiers

ProgramVersionName
ACDLabs10.044-methoxybenzoic acid
OpenEye OEToolkits1.5.04-methoxybenzoic acid

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs10.04O=C(O)c1ccc(OC)cc1
SMILES_CANONICALCACTVS3.341COc1ccc(cc1)C(O)=O
SMILESCACTVS3.341COc1ccc(cc1)C(O)=O
SMILES_CANONICALOpenEye OEToolkits1.5.0COc1ccc(cc1)C(=O)O
SMILESOpenEye OEToolkits1.5.0COc1ccc(cc1)C(=O)O
InChIInChI1.03InChI=1S/C8H8O3/c1-11-7-4-2-6(3-5-7)8(9)10/h2-5H,1H3,(H,9,10)
InChIKeyInChI1.03ZEYHEAKUIGZSGI-UHFFFAOYSA-N

217705

PDB entries from 2024-03-27

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