7-tert-butyl-1-cyclopropyl-6-fluoranyl-5-methyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-tert-butyl-1-cyclopropyl-6-fluoranyl-5-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-tert-butyl-1-cyclopropyl-6-fluoro-5-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-tert-butyl-1-cyclopropyl-6-fluoro-5-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-tert-butyl-1-cyclopropyl-6-fluoro-5-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-tert-butyl-1-cyclopropyl-6-fluoro-4-keto-5-methyl-quinoline-3-carboxylic acid Formula: C18H20FNO3 MolecularWeight: 317.354703

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC2=C1C(=O)C(=CN2C3CC3)C(=O)O)C(C)(C)C)F

Isomeric SMILES

CC1=C(C(=CC2=C1C(=O)C(=CN2C3CC3)C(=O)O)C(C)(C)C)F

InChI

InChI=1S/C18H20FNO3/c1-9-14-13(7-12(15(9)19)18(2,3)4)20(10-5-6-10)8-11(16(14)21)17(22)23/h7-8,10H,5-6H2,1-4H3,(H,22,23)