2-dimethylaminoethyl 6-fluoranyl-1-(4-fluorophenyl)-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: 2-dimethylaminoethyl 6-fluoranyl-1-(4-fluorophenyl)-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: 2-dimethylaminoethyl 6-fluoro-1-(4-fluorophenyl)-7-(4-methylpiperazin-1-yl)-4-oxo-quinoline-3-carboxylate CAS Name: 6-fluoro-1-(4-fluorophenyl)-7-(4-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid 2-dimethylaminoethyl ester IUPAC Name: 2-dimethylaminoethyl 6-fluoro-1-(4-fluorophenyl)-7-(4-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylate Traditional Name: 6-fluoro-1-(4-fluorophenyl)-4-keto-7-(4-methylpiperazino)quinoline-3-carboxylic acid 2-dimethylaminoethyl ester Formula: C25H28F2N4O3 MolecularWeight: 470.511626

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)OCCN(C)C)C4=CC=C(C=C4)F)F

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)OCCN(C)C)C4=CC=C(C=C4)F)F

InChI

InChI=1S/C25H28F2N4O3/c1-28(2)12-13-34-25(33)20-16-31(18-6-4-17(26)5-7-18)22-15-23(21(27)14-19(22)24(20)32)30-10-8-29(3)9-11-30/h4-7,14-16H,8-13H2,1-3H3