7-tert-butyl-1-cyclopropyl-8-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-tert-butyl-1-cyclopropyl-8-ethyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-tert-butyl-1-cyclopropyl-8-ethyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-tert-butyl-1-cyclopropyl-8-ethyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-tert-butyl-1-cyclopropyl-8-ethyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-tert-butyl-1-cyclopropyl-8-ethyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C19H22FNO3 MolecularWeight: 331.381283

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC(=C1C(C)(C)C)F)C(=O)C(=CN2C3CC3)C(=O)O

Isomeric SMILES

CCC1=C2C(=CC(=C1C(C)(C)C)F)C(=O)C(=CN2C3CC3)C(=O)O

InChI

InChI=1S/C19H22FNO3/c1-5-11-15(19(2,3)4)14(20)8-12-16(11)21(10-6-7-10)9-13(17(12)22)18(23)24/h8-10H,5-7H2,1-4H3,(H,23,24)