2,4-bis(fluoranyl)-5-(1-pyridin-3-ylethylamino)benzoic acid

Systemtic Name: 2,4-bis(fluoranyl)-5-(1-pyridin-3-ylethylamino)benzoic acid Openeye Name: 2,4-difluoro-5-[1-(3-pyridyl)ethylamino]benzoic acid CAS Name: 2,4-difluoro-5-[1-(3-pyridinyl)ethylamino]benzoic acid IUPAC Name: 2,4-difluoro-5-(1-pyridin-3-ylethylamino)benzoic acid Traditional Name: 2,4-difluoro-5-[1-(3-pyridyl)ethylamino]benzoic acid Formula: C14H12F2N2O2 MolecularWeight: 278.254086

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CN=CC=C1)NC2=C(C=C(C(=C2)C(=O)O)F)F

Isomeric SMILES

CC(C1=CN=CC=C1)NC2=C(C=C(C(=C2)C(=O)O)F)F

InChI

InChI=1S/C14H12F2N2O2/c1-8(9-3-2-4-17-7-9)18-13-5-10(14(19)20)11(15)6-12(13)16/h2-8,18H,1H3,(H,19,20)