1-cyclopropyl-7-[4-(2,2-dimethyl-6-oxidanyl-1,3-dioxepan-5-yl)piperazin-1-yl]-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-7-[4-(2,2-dimethyl-6-oxidanyl-1,3-dioxepan-5-yl)piperazin-1-yl]-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-7-[4-(6-hydroxy-2,2-dimethyl-1,3-dioxepan-5-yl)piperazin-1-yl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-7-[4-(6-hydroxy-2,2-dimethyl-1,3-dioxepan-5-yl)-1-piperazinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-7-[4-(6-hydroxy-2,2-dimethyl-1,3-dioxepan-5-yl)piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-7-[4-(6-hydroxy-2,2-dimethyl-1,3-dioxepan-5-yl)piperazino]-4-keto-quinoline-3-carboxylic acid Formula: C24H30FN3O6 MolecularWeight: 475.509903

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(C(CO1)O)N2CCN(CC2)C3=C(C=C4C(=C3)N(C=C(C4=O)C(=O)O)C5CC5)F)C

Isomeric SMILES

CC1(OCC(C(CO1)O)N2CCN(CC2)C3=C(C=C4C(=C3)N(C=C(C4=O)C(=O)O)C5CC5)F)C

InChI

InChI=1S/C24H30FN3O6/c1-24(2)33-12-20(21(29)13-34-24)27-7-5-26(6-8-27)19-10-18-15(9-17(19)25)22(30)16(23(31)32)11-28(18)14-3-4-14/h9-11,14,20-21,29H,3-8,12-13H2,1-2H3,(H,31,32)