7-[4-[bis(diethoxyphosphoryl)methyl]piperazin-1-yl]-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 7-[4-[bis(diethoxyphosphoryl)methyl]piperazin-1-yl]-1-cyclopropyl-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 7-[4-[bis(diethoxyphosphoryl)methyl]piperazin-1-yl]-1-cyclopropyl-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 7-[4-[bis(diethoxyphosphoryl)methyl]-1-piperazinyl]-1-cyclopropyl-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 7-[4-[bis(diethoxyphosphoryl)methyl]piperazin-1-yl]-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 7-[4-[bis(diethoxyphosphoryl)methyl]piperazino]-1-cyclopropyl-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C26H38FN3O9P2 MolecularWeight: 617.540545

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(N1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F)P(=O)(OCC)OCC)OCC

Isomeric SMILES

CCOP(=O)(C(N1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F)P(=O)(OCC)OCC)OCC

InChI

InChI=1S/C26H38FN3O9P2/c1-5-36-40(34,37-6-2)26(41(35,38-7-3)39-8-4)29-13-11-28(12-14-29)23-16-22-19(15-21(23)27)24(31)20(25(32)33)17-30(22)18-9-10-18/h15-18,26H,5-14H2,1-4H3,(H,32,33)