1-cyclopropyl-6-fluoranyl-7-(4-hexylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-7-(4-hexylpiperazin-1-yl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-7-(4-hexylpiperazin-1-yl)-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-7-(4-hexyl-1-piperazinyl)-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-7-(4-hexylpiperazin-1-yl)-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-7-(4-hexylpiperazino)-4-keto-quinoline-3-carboxylic acid Formula: C23H30FN3O3 MolecularWeight: 415.501003

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F

Isomeric SMILES

CCCCCCN1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F

InChI

InChI=1S/C23H30FN3O3/c1-2-3-4-5-8-25-9-11-26(12-10-25)21-14-20-17(13-19(21)24)22(28)18(23(29)30)15-27(20)16-6-7-16/h13-16H,2-12H2,1H3,(H,29,30)