3-[[2,5-bis(fluoranyl)phenyl]carbamoyl]pyrazine-2-carboxylic acid

Systemtic Name: 3-[[2,5-bis(fluoranyl)phenyl]carbamoyl]pyrazine-2-carboxylic acid Openeye Name: 3-[(2,5-difluorophenyl)carbamoyl]pyrazine-2-carboxylic acid CAS Name: 3-[(2,5-difluoroanilino)-oxomethyl]-2-pyrazinecarboxylic acid IUPAC Name: 3-[(2,5-difluorophenyl)carbamoyl]pyrazine-2-carboxylic acid Traditional Name: 3-[(2,5-difluorophenyl)carbamoyl]pyrazinoic acid Formula: C12H7F2N3O3 MolecularWeight: 279.199086

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1F)NC(=O)C2=NC=CN=C2C(=O)O)F

Isomeric SMILES

C1=CC(=C(C=C1F)NC(=O)C2=NC=CN=C2C(=O)O)F

InChI

InChI=1S/C12H7F2N3O3/c13-6-1-2-7(14)8(5-6)17-11(18)9-10(12(19)20)16-4-3-15-9/h1-5H,(H,17,18)(H,19,20)