7-(3-azanylpiperidin-1-yl)-1-cyclopropyl-8-ethynyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(3-azanylpiperidin-1-yl)-1-cyclopropyl-8-ethynyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(3-amino-1-piperidyl)-1-cyclopropyl-8-ethynyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(3-amino-1-piperidinyl)-1-cyclopropyl-8-ethynyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(3-aminopiperidin-1-yl)-1-cyclopropyl-8-ethynyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(3-aminopiperidino)-1-cyclopropyl-8-ethynyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C20H20FN3O3 MolecularWeight: 369.389503

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Descriptors Computed from Structure

Canonical SMILES:

C#CC1=C2C(=CC(=C1N3CCCC(C3)N)F)C(=O)C(=CN2C4CC4)C(=O)O

Isomeric SMILES

C#CC1=C2C(=CC(=C1N3CCCC(C3)N)F)C(=O)C(=CN2C4CC4)C(=O)O

InChI

InChI=1S/C20H20FN3O3/c1-2-13-17-14(8-16(21)18(13)23-7-3-4-11(22)9-23)19(25)15(20(26)27)10-24(17)12-5-6-12/h1,8,10-12H,3-7,9,22H2,(H,26,27)