3-[[6-[3-(trifluoromethyl)phenoxy]pyridin-3-yl]carbamoyl]pyrazine-2-carboxylic acid

Systemtic Name: 3-[[6-[3-(trifluoromethyl)phenoxy]pyridin-3-yl]carbamoyl]pyrazine-2-carboxylic acid Openeye Name: 3-[[6-[3-(trifluoromethyl)phenoxy]-3-pyridyl]carbamoyl]pyrazine-2-carboxylic acid CAS Name: 3-[oxo-[[6-[3-(trifluoromethyl)phenoxy]-3-pyridinyl]amino]methyl]-2-pyrazinecarboxylic acid IUPAC Name: 3-[[6-[3-(trifluoromethyl)phenoxy]pyridin-3-yl]carbamoyl]pyrazine-2-carboxylic acid Traditional Name: 3-[[6-[3-(trifluoromethyl)phenoxy]-3-pyridyl]carbamoyl]pyrazinoic acid Formula: C18H11F3N4O4 MolecularWeight: 404.29955

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OC2=NC=C(C=C2)NC(=O)C3=NC=CN=C3C(=O)O)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)OC2=NC=C(C=C2)NC(=O)C3=NC=CN=C3C(=O)O)C(F)(F)F

InChI

InChI=1S/C18H11F3N4O4/c19-18(20,21)10-2-1-3-12(8-10)29-13-5-4-11(9-24-13)25-16(26)14-15(17(27)28)23-7-6-22-14/h1-9H,(H,25,26)(H,27,28)