7-(3-azanylpyrrolidin-1-yl)-8-cyano-1-cyclopropyl-6-fluoranyl-5-methyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-(3-azanylpyrrolidin-1-yl)-8-cyano-1-cyclopropyl-6-fluoranyl-5-methyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-(3-aminopyrrolidin-1-yl)-8-cyano-1-cyclopropyl-6-fluoro-5-methyl-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-(3-amino-1-pyrrolidinyl)-8-cyano-1-cyclopropyl-6-fluoro-5-methyl-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-(3-aminopyrrolidin-1-yl)-8-cyano-1-cyclopropyl-6-fluoro-5-methyl-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-(3-aminopyrrolidino)-8-cyano-1-cyclopropyl-6-fluoro-4-keto-5-methyl-quinoline-3-carboxylic acid Formula: C19H19FN4O3 MolecularWeight: 370.377563

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(C(=C1F)N3CCC(C3)N)C#N)N(C=C(C2=O)C(=O)O)C4CC4

Isomeric SMILES

CC1=C2C(=C(C(=C1F)N3CCC(C3)N)C#N)N(C=C(C2=O)C(=O)O)C4CC4

InChI

InChI=1S/C19H19FN4O3/c1-9-14-16(24(11-2-3-11)8-13(18(14)25)19(26)27)12(6-21)17(15(9)20)23-5-4-10(22)7-23/h8,10-11H,2-5,7,22H2,1H3,(H,26,27)