1-cyclopropyl-6-fluoranyl-7-[4-[(6-methoxy-6-oxidanylidene-hexyl)carbamoyl]piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-7-[4-[(6-methoxy-6-oxidanylidene-hexyl)carbamoyl]piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-7-[4-[(6-methoxy-6-oxo-hexyl)carbamoyl]piperazin-1-yl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-7-[4-[[(6-methoxy-6-oxohexyl)amino]-oxomethyl]-1-piperazinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-7-[4-[(6-methoxy-6-oxohexyl)carbamoyl]piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-7-[4-[(6-keto-6-methoxy-hexyl)carbamoyl]piperazino]quinoline-3-carboxylic acid Formula: C25H31FN4O6 MolecularWeight: 502.535243

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCCCNC(=O)N1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F

Isomeric SMILES

COC(=O)CCCCCNC(=O)N1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F

InChI

InChI=1S/C25H31FN4O6/c1-36-22(31)5-3-2-4-8-27-25(35)29-11-9-28(10-12-29)21-14-20-17(13-19(21)26)23(32)18(24(33)34)15-30(20)16-6-7-16/h13-16H,2-12H2,1H3,(H,27,35)(H,33,34)