1-cyclopropyl-5-ethyl-6-fluoranyl-7-(3-methylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC(=C1F)N3CCNC(C3)C)N(C=C(C2=O)C(=O)O)C4CC4

Isomeric SMILES

CCC1=C2C(=CC(=C1F)N3CCNC(C3)C)N(C=C(C2=O)C(=O)O)C4CC4

InChI

InChI=1S/C20H24FN3O3/c1-3-13-17-15(8-16(18(13)21)23-7-6-22-11(2)9-23)24(12-4-5-12)10-14(19(17)25)20(26)27/h8,10-12,22H,3-7,9H2,1-2H3,(H,26,27)