1-ethyl-7-[4-[1-ethyl-2,5-bis(oxidanylidene)pyrrolidin-3-yl]piperazin-1-yl]-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-ethyl-7-[4-[1-ethyl-2,5-bis(oxidanylidene)pyrrolidin-3-yl]piperazin-1-yl]-6-fluoranyl-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-ethyl-7-[4-(1-ethyl-2,5-dioxo-pyrrolidin-3-yl)piperazin-1-yl]-6-fluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-ethyl-7-[4-(1-ethyl-2,5-dioxo-3-pyrrolidinyl)-1-piperazinyl]-6-fluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-ethyl-7-[4-(1-ethyl-2,5-dioxopyrrolidin-3-yl)piperazin-1-yl]-6-fluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-ethyl-7-[4-(1-ethyl-2,5-diketo-pyrrolidin-3-yl)piperazino]-6-fluoro-4-keto-quinoline-3-carboxylic acid Formula: C22H25FN4O5 MolecularWeight: 444.456103

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C4CC(=O)N(C4=O)CC)F)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)N3CCN(CC3)C4CC(=O)N(C4=O)CC)F)C(=O)O

InChI

InChI=1S/C22H25FN4O5/c1-3-24-12-14(22(31)32)20(29)13-9-15(23)17(10-16(13)24)25-5-7-26(8-6-25)18-11-19(28)27(4-2)21(18)30/h9-10,12,18H,3-8,11H2,1-2H3,(H,31,32)