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

Systemtic Name: 1-cyclopropyl-6-fluoranyl-2-heptan-2-yl-8-methoxy-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-8-methoxy-2-(1-methylhexyl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-2-heptan-2-yl-8-methoxy-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-2-heptan-2-yl-8-methoxy-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-8-methoxy-2-(1-methylhexyl)quinoline-3-carboxylic acid Formula: C21H26FNO4 MolecularWeight: 375.433843

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26FNO4/c1-4-5-6-7-12(2)18-17(21(25)26)20(24)15-10-13(22)11-16(27-3)19(15)23(18)14-8-9-14/h10-12,14H,4-9H2,1-3H3,(H,25,26)