6-[[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]amino]pyridine-3-carboxylate

Systemtic Name: 6-[[2,2-bis(fluoranyl)-1,3-benzodioxol-5-yl]amino]pyridine-3-carboxylate Openeye Name: 6-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]pyridine-3-carboxylate CAS Name: 6-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]-3-pyridinecarboxylate IUPAC Name: 6-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]pyridine-3-carboxylate Traditional Name: 6-[(2,2-difluoro-1,3-benzodioxol-5-yl)amino]nicotinate Formula: C13H7F2N2O4- MolecularWeight: 293.202486

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1NC3=NC=C(C=C3)C(=O)[O-])OC(O2)(F)F

Isomeric SMILES

C1=CC2=C(C=C1NC3=NC=C(C=C3)C(=O)[O-])OC(O2)(F)F

InChI

InChI=1S/C13H8F2N2O4/c14-13(15)20-9-3-2-8(5-10(9)21-13)17-11-4-1-7(6-16-11)12(18)19/h1-6H,(H,16,17)(H,18,19)/p-1