2-[2-(2-azanylpropanoylamino)pyrrolidin-1-yl]-1-cyclopropyl-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 2-[2-(2-azanylpropanoylamino)pyrrolidin-1-yl]-1-cyclopropyl-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 2-[2-(2-aminopropanoylamino)pyrrolidin-1-yl]-1-cyclopropyl-6,8-difluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 2-[2-[(2-amino-1-oxopropyl)amino]-1-pyrrolidinyl]-1-cyclopropyl-6,8-difluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 2-[2-(2-aminopropanoylamino)pyrrolidin-1-yl]-1-cyclopropyl-6,8-difluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 2-[2-(alanylamino)pyrrolidino]-1-cyclopropyl-6,8-difluoro-4-keto-quinoline-3-carboxylic acid Formula: C20H22F2N4O4 MolecularWeight: 420.409886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCN1C2=C(C(=O)C3=CC(=CC(=C3N2C4CC4)F)F)C(=O)O)N

Isomeric SMILES

CC(C(=O)NC1CCCN1C2=C(C(=O)C3=CC(=CC(=C3N2C4CC4)F)F)C(=O)O)N

InChI

InChI=1S/C20H22F2N4O4/c1-9(23)18(28)24-14-3-2-6-25(14)19-15(20(29)30)17(27)12-7-10(21)8-13(22)16(12)26(19)11-4-5-11/h7-9,11,14H,2-6,23H2,1H3,(H,24,28)(H,29,30)