2-[2-(2-azanylpropanoylamino)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 2-[2-(2-azanylpropanoylamino)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 2-[2-(2-aminopropanoylamino)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 2-[2-[(2-amino-1-oxopropyl)amino]-1-pyrrolidinyl]-1-cyclopropyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 2-[2-(2-aminopropanoylamino)pyrrolidin-1-yl]-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 2-[2-(alanylamino)pyrrolidino]-1-cyclopropyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C20H23FN4O4 MolecularWeight: 402.419423

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCN1C2=C(C(=O)C3=C(N2C4CC4)C=CC(=C3)F)C(=O)O)N

Isomeric SMILES

CC(C(=O)NC1CCCN1C2=C(C(=O)C3=C(N2C4CC4)C=CC(=C3)F)C(=O)O)N

InChI

InChI=1S/C20H23FN4O4/c1-10(22)18(27)23-15-3-2-8-24(15)19-16(20(28)29)17(26)13-9-11(21)4-7-14(13)25(19)12-5-6-12/h4,7,9-10,12,15H,2-3,5-6,8,22H2,1H3,(H,23,27)(H,28,29)