3-(butoxycarbonylamino)-1-cyclopropyl-6,8-bis(fluoranyl)-4-oxidanylidene-2-pyrrolidin-1-yl-2H-quinoline-3-carboxylic acid

Systemtic Name: 3-(butoxycarbonylamino)-1-cyclopropyl-6,8-bis(fluoranyl)-4-oxidanylidene-2-pyrrolidin-1-yl-2H-quinoline-3-carboxylic acid Openeye Name: 3-(butoxycarbonylamino)-1-cyclopropyl-6,8-difluoro-4-oxo-2-pyrrolidin-1-yl-2H-quinoline-3-carboxylic acid CAS Name: 3-[[butoxy(oxo)methyl]amino]-1-cyclopropyl-6,8-difluoro-4-oxo-2-(1-pyrrolidinyl)-2H-quinoline-3-carboxylic acid IUPAC Name: 3-(butoxycarbonylamino)-1-cyclopropyl-6,8-difluoro-4-oxo-2-pyrrolidin-1-yl-2H-quinoline-3-carboxylic acid Traditional Name: 3-(butoxycarbonylamino)-1-cyclopropyl-6,8-difluoro-4-keto-2-pyrrolidino-2H-quinoline-3-carboxylic acid Formula: C22H27F2N3O5 MolecularWeight: 451.463686

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)NC1(C(N(C2=C(C=C(C=C2C1=O)F)F)C3CC3)N4CCCC4)C(=O)O

Isomeric SMILES

CCCCOC(=O)NC1(C(N(C2=C(C=C(C=C2C1=O)F)F)C3CC3)N4CCCC4)C(=O)O

InChI

InChI=1S/C22H27F2N3O5/c1-2-3-10-32-21(31)25-22(20(29)30)18(28)15-11-13(23)12-16(24)17(15)27(14-6-7-14)19(22)26-8-4-5-9-26/h11-12,14,19H,2-10H2,1H3,(H,25,31)(H,29,30)