1-cyclopropyl-7-[3-(diethylaminomethyl)pyrrolidin-1-yl]-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-7-[3-(diethylaminomethyl)pyrrolidin-1-yl]-6,8-bis(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-7-[3-(diethylaminomethyl)pyrrolidin-1-yl]-6,8-difluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-7-[3-(diethylaminomethyl)-1-pyrrolidinyl]-6,8-difluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-7-[3-(diethylaminomethyl)pyrrolidin-1-yl]-6,8-difluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-7-[3-(diethylaminomethyl)pyrrolidino]-6,8-difluoro-4-keto-quinoline-3-carboxylic acid Formula: C22H27F2N3O3 MolecularWeight: 419.464886

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1CCN(C1)C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)O)C4CC4)F

Isomeric SMILES

CCN(CC)CC1CCN(C1)C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)O)C4CC4)F

InChI

InChI=1S/C22H27F2N3O3/c1-3-25(4-2)10-13-7-8-26(11-13)20-17(23)9-15-19(18(20)24)27(14-5-6-14)12-16(21(15)28)22(29)30/h9,12-14H,3-8,10-11H2,1-2H3,(H,29,30)