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

Systemtic Name: 7-[3-(ethylaminomethyl)pyrrolidin-1-yl]-6-fluoranyl-1-(4-fluorophenyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[3-(ethylaminomethyl)pyrrolidin-1-yl]-6-fluoro-1-(4-fluorophenyl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[3-(ethylaminomethyl)-1-pyrrolidinyl]-6-fluoro-1-(4-fluorophenyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[3-(ethylaminomethyl)pyrrolidin-1-yl]-6-fluoro-1-(4-fluorophenyl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[3-(ethylaminomethyl)pyrrolidino]-6-fluoro-1-(4-fluorophenyl)-4-keto-quinoline-3-carboxylic acid Formula: C23H23F2N3O3 MolecularWeight: 427.443826

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Descriptors Computed from Structure

Canonical SMILES:

CCNCC1CCN(C1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=CC=C(C=C4)F)F

Isomeric SMILES

CCNCC1CCN(C1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=CC=C(C=C4)F)F

InChI

InChI=1S/C23H23F2N3O3/c1-2-26-11-14-7-8-27(12-14)21-10-20-17(9-19(21)25)22(29)18(23(30)31)13-28(20)16-5-3-15(24)4-6-16/h3-6,9-10,13-14,26H,2,7-8,11-12H2,1H3,(H,30,31)