3-[[3-(trifluoromethyl)phenyl]carbamoyl]pyrazine-2-carboxylic acid

Systemtic Name: 3-[[3-(trifluoromethyl)phenyl]carbamoyl]pyrazine-2-carboxylic acid Openeye Name: 3-[[3-(trifluoromethyl)phenyl]carbamoyl]pyrazine-2-carboxylic acid CAS Name: 3-[oxo-[3-(trifluoromethyl)anilino]methyl]-2-pyrazinecarboxylic acid IUPAC Name: 3-[[3-(trifluoromethyl)phenyl]carbamoyl]pyrazine-2-carboxylic acid Traditional Name: 3-[[3-(trifluoromethyl)phenyl]carbamoyl]pyrazinoic acid Formula: C13H8F3N3O3 MolecularWeight: 311.21613

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=NC=CN=C2C(=O)O)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=NC=CN=C2C(=O)O)C(F)(F)F

InChI

InChI=1S/C13H8F3N3O3/c14-13(15,16)7-2-1-3-8(6-7)19-11(20)9-10(12(21)22)18-5-4-17-9/h1-6H,(H,19,20)(H,21,22)