7-(cyclohexylamino)-1-cyclopentyl-6-fluoranyl-2-methyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(cyclohexylamino)-1-cyclopentyl-6-fluoranyl-2-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(cyclohexylamino)-1-cyclopentyl-6-fluoro-2-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(cyclohexylamino)-1-cyclopentyl-6-fluoro-2-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(cyclohexylamino)-1-cyclopentyl-6-fluoro-2-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(cyclohexylamino)-1-cyclopentyl-6-fluoro-4-keto-2-methyl-quinoline-3-carboxylic acid Formula: C22H27FN2O3 MolecularWeight: 386.459783

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=CC(=C(C=C2N1C3CCCC3)NC4CCCCC4)F)C(=O)O

Isomeric SMILES

CC1=C(C(=O)C2=CC(=C(C=C2N1C3CCCC3)NC4CCCCC4)F)C(=O)O

InChI

InChI=1S/C22H27FN2O3/c1-13-20(22(27)28)21(26)16-11-17(23)18(24-14-7-3-2-4-8-14)12-19(16)25(13)15-9-5-6-10-15/h11-12,14-15,24H,2-10H2,1H3,(H,27,28)