5-fluoranyl-2-[[(Z)-3-quinolin-3-ylbut-2-enoyl]amino]benzoic acid

Systemtic Name: 5-fluoranyl-2-[[(Z)-3-quinolin-3-ylbut-2-enoyl]amino]benzoic acid Openeye Name: 5-fluoro-2-[[(Z)-3-(3-quinolyl)but-2-enoyl]amino]benzoic acid CAS Name: 5-fluoro-2-[[(Z)-1-oxo-3-(3-quinolinyl)but-2-enyl]amino]benzoic acid IUPAC Name: 5-fluoro-2-[[(Z)-3-quinolin-3-ylbut-2-enoyl]amino]benzoic acid Traditional Name: 5-fluoro-2-[[(Z)-3-(3-quinolyl)but-2-enoyl]amino]benzoic acid Formula: C20H15FN2O3 MolecularWeight: 350.343103

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=C(C=C(C=C1)F)C(=O)O)C2=CC3=CC=CC=C3N=C2

Isomeric SMILES

C/C(=C/C(=O)NC1=C(C=C(C=C1)F)C(=O)O)/C2=CC3=CC=CC=C3N=C2

InChI

InChI=1S/C20H15FN2O3/c1-12(14-9-13-4-2-3-5-17(13)22-11-14)8-19(24)23-18-7-6-15(21)10-16(18)20(25)26/h2-11H,1H3,(H,23,24)(H,25,26)/b12-8-