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

Systemtic Name: ethyl 6-azanyl-1-cyclopropyl-8-fluoranyl-7-(4-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 6-amino-1-cyclopropyl-8-fluoro-7-(4-methylpiperazin-1-yl)-4-oxo-quinoline-3-carboxylate CAS Name: 6-amino-1-cyclopropyl-8-fluoro-7-(4-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-amino-1-cyclopropyl-8-fluoro-7-(4-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylate Traditional Name: 6-amino-1-cyclopropyl-8-fluoro-4-keto-7-(4-methylpiperazino)quinoline-3-carboxylic acid ethyl ester Formula: C20H25FN4O3 MolecularWeight: 388.435903

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=C(C(=C(C=C2C1=O)N)N3CCN(CC3)C)F)C4CC4

Isomeric SMILES

CCOC(=O)C1=CN(C2=C(C(=C(C=C2C1=O)N)N3CCN(CC3)C)F)C4CC4

InChI

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