7-(1,3-dihydroisoindol-2-yl)-1-ethyl-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(1,3-dihydroisoindol-2-yl)-1-ethyl-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-ethyl-6,8-difluoro-7-isoindolin-2-yl-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(1,3-dihydroisoindol-2-yl)-1-ethyl-6,8-difluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(1,3-dihydroisoindol-2-yl)-1-ethyl-6,8-difluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-ethyl-6,8-difluoro-7-isoindolin-2-yl-4-keto-quinoline-3-carboxylic acid Formula: C20H16F2N2O3 MolecularWeight: 370.349446

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C(=C21)F)N3CC4=CC=CC=C4C3)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C(=C21)F)N3CC4=CC=CC=C4C3)F)C(=O)O

InChI

InChI=1S/C20H16F2N2O3/c1-2-23-10-14(20(26)27)19(25)13-7-15(21)18(16(22)17(13)23)24-8-11-5-3-4-6-12(11)9-24/h3-7,10H,2,8-9H2,1H3,(H,26,27)