1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-[(4-propan-2-ylphenyl)amino]quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-[(4-propan-2-ylphenyl)amino]quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-7-(4-isopropylanilino)-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-4-oxo-7-(4-propan-2-ylanilino)-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-4-oxo-7-(4-propan-2-ylanilino)quinoline-3-carboxylic acid Traditional Name: 7-cumidino-1-cyclopropyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C22H21FN2O3 MolecularWeight: 380.412143

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F

InChI

InChI=1S/C22H21FN2O3/c1-12(2)13-3-5-14(6-4-13)24-19-10-20-16(9-18(19)23)21(26)17(22(27)28)11-25(20)15-7-8-15/h3-6,9-12,15,24H,7-8H2,1-2H3,(H,27,28)