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

Systemtic Name: 1-cyclopropyl-7-[4-(furan-2-ylcarbonyl)piperazin-1-yl]-6-nitro-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-7-[4-(furan-2-carbonyl)piperazin-1-yl]-6-nitro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-7-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-6-nitro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-7-[4-(furan-2-carbonyl)piperazin-1-yl]-6-nitro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-7-[4-(2-furoyl)piperazino]-4-keto-6-nitro-quinoline-3-carboxylic acid Formula: C22H20N4O7 MolecularWeight: 452.4168

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCN(CC4)C(=O)C5=CC=CO5)[N+](=O)[O-])C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCN(CC4)C(=O)C5=CC=CO5)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C22H20N4O7/c27-20-14-10-18(26(31)32)17(11-16(14)25(13-3-4-13)12-15(20)22(29)30)23-5-7-24(8-6-23)21(28)19-2-1-9-33-19/h1-2,9-13H,3-8H2,(H,29,30)