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

Systemtic Name: 7-[3-(ethylaminomethyl)pyrrolidin-1-yl]-6,8-bis(fluoranyl)-4-oxidanylidene-1-phenyl-quinoline-3-carboxylic acid Openeye Name: 7-[3-(ethylaminomethyl)pyrrolidin-1-yl]-6,8-difluoro-4-oxo-1-phenyl-quinoline-3-carboxylic acid CAS Name: 7-[3-(ethylaminomethyl)-1-pyrrolidinyl]-6,8-difluoro-4-oxo-1-phenyl-3-quinolinecarboxylic acid IUPAC Name: 7-[3-(ethylaminomethyl)pyrrolidin-1-yl]-6,8-difluoro-4-oxo-1-phenylquinoline-3-carboxylic acid Traditional Name: 7-[3-(ethylaminomethyl)pyrrolidino]-6,8-difluoro-4-keto-1-phenyl-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(=C2F)N(C=C(C3=O)C(=O)O)C4=CC=CC=C4)F

Isomeric SMILES

CCNCC1CCN(C1)C2=C(C=C3C(=C2F)N(C=C(C3=O)C(=O)O)C4=CC=CC=C4)F

InChI

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