3-(3,5-dimethylphenoxy)carbonylpyrazine-2-carboxylic acid

Systemtic Name: 3-(3,5-dimethylphenoxy)carbonylpyrazine-2-carboxylic acid Openeye Name: 3-(3,5-dimethylphenoxy)carbonylpyrazine-2-carboxylic acid CAS Name: 3-[(3,5-dimethylphenoxy)-oxomethyl]-2-pyrazinecarboxylic acid IUPAC Name: 3-(3,5-dimethylphenoxy)carbonylpyrazine-2-carboxylic acid Traditional Name: 3-(3,5-dimethylphenoxy)carbonylpyrazinoic acid Formula: C14H12N2O4 MolecularWeight: 272.25608

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC(=O)C2=NC=CN=C2C(=O)O)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC(=O)C2=NC=CN=C2C(=O)O)C

InChI

InChI=1S/C14H12N2O4/c1-8-5-9(2)7-10(6-8)20-14(19)12-11(13(17)18)15-3-4-16-12/h3-7H,1-2H3,(H,17,18)