ethyl 5,6-bis(azanyl)-1-cyclopropyl-8-fluoranyl-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylate

Systemtic Name: ethyl 5,6-bis(azanyl)-1-cyclopropyl-8-fluoranyl-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 5,6-diamino-1-cyclopropyl-8-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-quinoline-3-carboxylate CAS Name: 5,6-diamino-1-cyclopropyl-8-fluoro-7-(4-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 5,6-diamino-1-cyclopropyl-8-fluoro-7-(4-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylate Traditional Name: 5,6-diamino-1-cyclopropyl-8-fluoro-4-keto-7-(4-methylpiperazino)quinoline-3-carboxylic acid ethyl ester Formula: C20H26FN5O3 MolecularWeight: 403.450543

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=C(C1=O)C(=C(C(=C2F)N3CCN(CC3)C)N)N)C4CC4

Isomeric SMILES

CCOC(=O)C1=CN(C2=C(C1=O)C(=C(C(=C2F)N3CCN(CC3)C)N)N)C4CC4

InChI

InChI=1S/C20H26FN5O3/c1-3-29-20(28)12-10-26(11-4-5-11)17-13(19(12)27)15(22)16(23)18(14(17)21)25-8-6-24(2)7-9-25/h10-11H,3-9,22-23H2,1-2H3