1-tert-butyl-7-chloranyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-tert-butyl-7-chloranyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-tert-butyl-7-chloro-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-tert-butyl-7-chloro-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-tert-butyl-7-chloro-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-tert-butyl-7-chloro-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C14H13ClFNO3 MolecularWeight: 297.709323

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N1C=C(C(=O)C2=CC(=C(C=C21)Cl)F)C(=O)O

Isomeric SMILES

CC(C)(C)N1C=C(C(=O)C2=CC(=C(C=C21)Cl)F)C(=O)O

InChI

InChI=1S/C14H13ClFNO3/c1-14(2,3)17-6-8(13(19)20)12(18)7-4-10(16)9(15)5-11(7)17/h4-6H,1-3H3,(H,19,20)