1-cyclopropyl-6-fluoranyl-8-methoxy-2-octan-3-yl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-8-methoxy-2-octan-3-yl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-2-(1-ethylhexyl)-6-fluoro-8-methoxy-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-8-methoxy-2-octan-3-yl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-8-methoxy-2-octan-3-yl-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-2-(1-ethylhexyl)-6-fluoro-4-keto-8-methoxy-quinoline-3-carboxylic acid Formula: C22H28FNO4 MolecularWeight: 389.460423

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)C1=C(C(=O)C2=CC(=CC(=C2N1C3CC3)OC)F)C(=O)O

Isomeric SMILES

CCCCCC(CC)C1=C(C(=O)C2=CC(=CC(=C2N1C3CC3)OC)F)C(=O)O

InChI

InChI=1S/C22H28FNO4/c1-4-6-7-8-13(5-2)19-18(22(26)27)21(25)16-11-14(23)12-17(28-3)20(16)24(19)15-9-10-15/h11-13,15H,4-10H2,1-3H3,(H,26,27)