ethyl 6-azanyl-1-cyclopropyl-8-fluoranyl-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-2-carboxylate

Systemtic Name: ethyl 6-azanyl-1-cyclopropyl-8-fluoranyl-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-2-carboxylate Openeye Name: ethyl 6-amino-1-cyclopropyl-8-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-quinoline-2-carboxylate CAS Name: 6-amino-1-cyclopropyl-8-fluoro-7-(4-methyl-1-piperazinyl)-4-oxo-2-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-1-cyclopropyl-8-fluoro-7-(4-methylpiperazin-1-yl)-4-oxoquinoline-2-carboxylate Traditional Name: 6-amino-1-cyclopropyl-8-fluoro-4-keto-7-(4-methylpiperazino)quinaldic acid ethyl ester Formula: C20H25FN4O3 MolecularWeight: 388.435903

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=O)C2=CC(=C(C(=C2N1C3CC3)F)N4CCN(CC4)C)N

Isomeric SMILES

CCOC(=O)C1=CC(=O)C2=CC(=C(C(=C2N1C3CC3)F)N4CCN(CC4)C)N

InChI

InChI=1S/C20H25FN4O3/c1-3-28-20(27)15-11-16(26)13-10-14(22)19(24-8-6-23(2)7-9-24)17(21)18(13)25(15)12-4-5-12/h10-12H,3-9,22H2,1-2H3