ethyl 1-cyclopropyl-6-fluoranyl-5-methyl-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylate

Systemtic Name: ethyl 1-cyclopropyl-6-fluoranyl-5-methyl-4-oxidanylidene-7-piperazin-1-yl-quinoline-3-carboxylate Openeye Name: ethyl 1-cyclopropyl-6-fluoro-5-methyl-4-oxo-7-piperazin-1-yl-quinoline-3-carboxylate CAS Name: 1-cyclopropyl-6-fluoro-5-methyl-4-oxo-7-(1-piperazinyl)-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-cyclopropyl-6-fluoro-5-methyl-4-oxo-7-piperazin-1-ylquinoline-3-carboxylate Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-5-methyl-7-piperazino-quinoline-3-carboxylic acid ethyl ester Formula: C20H24FN3O3 MolecularWeight: 373.421263

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=CC(=C(C(=C2C1=O)C)F)N3CCNCC3)C4CC4

Isomeric SMILES

CCOC(=O)C1=CN(C2=CC(=C(C(=C2C1=O)C)F)N3CCNCC3)C4CC4

InChI

InChI=1S/C20H24FN3O3/c1-3-27-20(26)14-11-24(13-4-5-13)15-10-16(23-8-6-22-7-9-23)18(21)12(2)17(15)19(14)25/h10-11,13,22H,3-9H2,1-2H3