1-(4-fluorophenyl)-7-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-6-nitro-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-(4-fluorophenyl)-7-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-6-nitro-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-(4-fluorophenyl)-7-[4-(furan-2-carbonyl)piperazin-1-yl]-6-nitro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-(4-fluorophenyl)-7-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-6-nitro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-(4-fluorophenyl)-7-[4-(furan-2-carbonyl)piperazin-1-yl]-6-nitro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-(4-fluorophenyl)-7-[4-(2-furoyl)piperazino]-4-keto-6-nitro-quinoline-3-carboxylic acid Formula: C25H19FN4O7 MolecularWeight: 506.439363

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=CC=C(C=C4)F)[N+](=O)[O-])C(=O)C5=CC=CO5

Isomeric SMILES

C1CN(CCN1C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4=CC=C(C=C4)F)[N+](=O)[O-])C(=O)C5=CC=CO5

InChI

InChI=1S/C25H19FN4O7/c26-15-3-5-16(6-4-15)29-14-18(25(33)34)23(31)17-12-21(30(35)36)20(13-19(17)29)27-7-9-28(10-8-27)24(32)22-2-1-11-37-22/h1-6,11-14H,7-10H2,(H,33,34)