3-(4-carboxyphenyl)-5-methyl-1,2-oxazole-4-carboxylic acid

Systemtic Name: 3-(4-carboxyphenyl)-5-methyl-1,2-oxazole-4-carboxylic acid Openeye Name: 3-(4-carboxyphenyl)-5-methyl-isoxazole-4-carboxylic acid CAS Name: 3-(4-carboxyphenyl)-5-methyl-4-isoxazolecarboxylic acid IUPAC Name: 3-(4-carboxyphenyl)-5-methyl-1,2-oxazole-4-carboxylic acid Traditional Name: 3-(4-carboxyphenyl)-5-methyl-isoxazole-4-carboxylic acid Formula: C12H9NO5 MolecularWeight: 247.20356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C2=CC=C(C=C2)C(=O)O)C(=O)O

Isomeric SMILES

CC1=C(C(=NO1)C2=CC=C(C=C2)C(=O)O)C(=O)O

InChI

InChI=1S/C12H9NO5/c1-6-9(12(16)17)10(13-18-6)7-2-4-8(5-3-7)11(14)15/h2-5H,1H3,(H,14,15)(H,16,17)