5-fluoranyl-4-oxidanylidene-1-[(4-pyrrolo[3,2-c]pyridin-1-ylphenyl)methyl]quinoline-3-carboxylic acid

Systemtic Name: 5-fluoranyl-4-oxidanylidene-1-[(4-pyrrolo[3,2-c]pyridin-1-ylphenyl)methyl]quinoline-3-carboxylic acid Openeye Name: 5-fluoro-4-oxo-1-[(4-pyrrolo[3,2-c]pyridin-1-ylphenyl)methyl]quinoline-3-carboxylic acid CAS Name: 5-fluoro-4-oxo-1-[[4-(1-pyrrolo[3,2-c]pyridinyl)phenyl]methyl]-3-quinolinecarboxylic acid IUPAC Name: 5-fluoro-4-oxo-1-[(4-pyrrolo[3,2-c]pyridin-1-ylphenyl)methyl]quinoline-3-carboxylic acid Traditional Name: 5-fluoro-4-keto-1-(4-pyrrolo[3,2-c]pyridin-1-ylbenzyl)quinoline-3-carboxylic acid Formula: C24H16FN3O3 MolecularWeight: 413.400543

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)F)C(=O)C(=CN2CC3=CC=C(C=C3)N4C=CC5=C4C=CN=C5)C(=O)O

Isomeric SMILES

C1=CC2=C(C(=C1)F)C(=O)C(=CN2CC3=CC=C(C=C3)N4C=CC5=C4C=CN=C5)C(=O)O

InChI

InChI=1S/C24H16FN3O3/c25-19-2-1-3-21-22(19)23(29)18(24(30)31)14-27(21)13-15-4-6-17(7-5-15)28-11-9-16-12-26-10-8-20(16)28/h1-12,14H,13H2,(H,30,31)