1-[(2-cyanophenyl)methyl]-5,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-[(2-cyanophenyl)methyl]-5,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-[(2-cyanophenyl)methyl]-5,8-difluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-[(2-cyanophenyl)methyl]-5,8-difluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-[(2-cyanophenyl)methyl]-5,8-difluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-(2-cyanobenzyl)-5,8-difluoro-4-keto-quinoline-3-carboxylic acid Formula: C18H10F2N2O3 MolecularWeight: 340.280406

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CN2C=C(C(=O)C3=C(C=CC(=C32)F)F)C(=O)O)C#N

Isomeric SMILES

C1=CC=C(C(=C1)CN2C=C(C(=O)C3=C(C=CC(=C32)F)F)C(=O)O)C#N

InChI

InChI=1S/C18H10F2N2O3/c19-13-5-6-14(20)16-15(13)17(23)12(18(24)25)9-22(16)8-11-4-2-1-3-10(11)7-21/h1-6,9H,8H2,(H,24,25)