1-(4-azanyl-2-fluoranyl-phenyl)-4-oxidanylidene-7-piperidin-1-yl-quinoline-3-carboxylic acid

Systemtic Name: 1-(4-azanyl-2-fluoranyl-phenyl)-4-oxidanylidene-7-piperidin-1-yl-quinoline-3-carboxylic acid Openeye Name: 1-(4-amino-2-fluoro-phenyl)-4-oxo-7-(1-piperidyl)quinoline-3-carboxylic acid CAS Name: 1-(4-amino-2-fluorophenyl)-4-oxo-7-(1-piperidinyl)-3-quinolinecarboxylic acid IUPAC Name: 1-(4-amino-2-fluorophenyl)-4-oxo-7-piperidin-1-ylquinoline-3-carboxylic acid Traditional Name: 1-(4-amino-2-fluoro-phenyl)-4-keto-7-piperidino-quinoline-3-carboxylic acid Formula: C21H20FN3O3 MolecularWeight: 381.400203

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC3=C(C=C2)C(=O)C(=CN3C4=C(C=C(C=C4)N)F)C(=O)O

Isomeric SMILES

C1CCN(CC1)C2=CC3=C(C=C2)C(=O)C(=CN3C4=C(C=C(C=C4)N)F)C(=O)O

InChI

InChI=1S/C21H20FN3O3/c22-17-10-13(23)4-7-18(17)25-12-16(21(27)28)20(26)15-6-5-14(11-19(15)25)24-8-2-1-3-9-24/h4-7,10-12H,1-3,8-9,23H2,(H,27,28)