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

Systemtic Name: ethyl 5-azanyl-1-cyclopropyl-6,8-bis(fluoranyl)-7-(3-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylate Openeye Name: ethyl 5-amino-1-cyclopropyl-6,8-difluoro-7-(3-methylpiperazin-1-yl)-4-oxo-quinoline-3-carboxylate CAS Name: 5-amino-1-cyclopropyl-6,8-difluoro-7-(3-methyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-1-cyclopropyl-6,8-difluoro-7-(3-methylpiperazin-1-yl)-4-oxoquinoline-3-carboxylate Traditional Name: 5-amino-1-cyclopropyl-6,8-difluoro-4-keto-7-(3-methylpiperazino)quinoline-3-carboxylic acid ethyl ester Formula: C20H24F2N4O3 MolecularWeight: 406.426366

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=C(C1=O)C(=C(C(=C2F)N3CCNC(C3)C)F)N)C4CC4

Isomeric SMILES

CCOC(=O)C1=CN(C2=C(C1=O)C(=C(C(=C2F)N3CCNC(C3)C)F)N)C4CC4

InChI

InChI=1S/C20H24F2N4O3/c1-3-29-20(28)12-9-26(11-4-5-11)17-13(19(12)27)16(23)14(21)18(15(17)22)25-7-6-24-10(2)8-25/h9-11,24H,3-8,23H2,1-2H3