1-ethyl-6-fluoranyl-7-[2-(octanoyloxymethoxycarbonyl)piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-ethyl-6-fluoranyl-7-[2-(octanoyloxymethoxycarbonyl)piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-ethyl-6-fluoro-7-[2-(octanoyloxymethoxycarbonyl)piperazin-1-yl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-ethyl-6-fluoro-4-oxo-7-[2-[oxo(1-oxooctoxymethoxy)methyl]-1-piperazinyl]-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-6-fluoro-7-[2-(octanoyloxymethoxycarbonyl)piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[2-(caprylyloxymethoxycarbonyl)piperazino]-1-ethyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C26H34FN3O7 MolecularWeight: 519.562463

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)OCOC(=O)C1CNCCN1C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)CC)F

Isomeric SMILES

CCCCCCCC(=O)OCOC(=O)C1CNCCN1C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)CC)F

InChI

InChI=1S/C26H34FN3O7/c1-3-5-6-7-8-9-23(31)36-16-37-26(35)22-14-28-10-11-30(22)21-13-20-17(12-19(21)27)24(32)18(25(33)34)15-29(20)4-2/h12-13,15,22,28H,3-11,14,16H2,1-2H3,(H,33,34)