1-ethyl-7-[3-(ethylaminomethyl)pyrrolidin-1-yl]-6-fluoranyl-4-oxidanylidene-8-(trifluoromethyl)quinoline-3-carboxylic acid

Systemtic Name: 1-ethyl-7-[3-(ethylaminomethyl)pyrrolidin-1-yl]-6-fluoranyl-4-oxidanylidene-8-(trifluoromethyl)quinoline-3-carboxylic acid Openeye Name: 1-ethyl-7-[3-(ethylaminomethyl)pyrrolidin-1-yl]-6-fluoro-4-oxo-8-(trifluoromethyl)quinoline-3-carboxylic acid CAS Name: 1-ethyl-7-[3-(ethylaminomethyl)-1-pyrrolidinyl]-6-fluoro-4-oxo-8-(trifluoromethyl)-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-7-[3-(ethylaminomethyl)pyrrolidin-1-yl]-6-fluoro-4-oxo-8-(trifluoromethyl)quinoline-3-carboxylic acid Traditional Name: 1-ethyl-7-[3-(ethylaminomethyl)pyrrolidino]-6-fluoro-4-keto-8-(trifluoromethyl)quinoline-3-carboxylic acid Formula: C20H23F4N3O3 MolecularWeight: 429.408533

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC1CCN(C1)C2=C(C=C3C(=C2C(F)(F)F)N(C=C(C3=O)C(=O)O)CC)F

Isomeric SMILES

CCNCC1CCN(C1)C2=C(C=C3C(=C2C(F)(F)F)N(C=C(C3=O)C(=O)O)CC)F

InChI

InChI=1S/C20H23F4N3O3/c1-3-25-8-11-5-6-27(9-11)17-14(21)7-12-16(15(17)20(22,23)24)26(4-2)10-13(18(12)28)19(29)30/h7,10-11,25H,3-6,8-9H2,1-2H3,(H,29,30)