1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-[4-[(pyrazin-2-ylcarbonylamino)methyl]piperazin-1-yl]quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-4-oxidanylidene-7-[4-[(pyrazin-2-ylcarbonylamino)methyl]piperazin-1-yl]quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-4-oxo-7-[4-[(pyrazine-2-carbonylamino)methyl]piperazin-1-yl]quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-4-oxo-7-[4-[[[oxo(2-pyrazinyl)methyl]amino]methyl]-1-piperazinyl]-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-4-oxo-7-[4-[(pyrazine-2-carbonylamino)methyl]piperazin-1-yl]quinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-7-[4-[(pyrazinoylamino)methyl]piperazino]quinoline-3-carboxylic acid Formula: C23H23FN6O4 MolecularWeight: 466.464923

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCN(CC4)CNC(=O)C5=NC=CN=C5)F)C(=O)O

Isomeric SMILES

C1CC1N2C=C(C(=O)C3=CC(=C(C=C32)N4CCN(CC4)CNC(=O)C5=NC=CN=C5)F)C(=O)O

InChI

InChI=1S/C23H23FN6O4/c24-17-9-15-19(30(14-1-2-14)12-16(21(15)31)23(33)34)10-20(17)29-7-5-28(6-8-29)13-27-22(32)18-11-25-3-4-26-18/h3-4,9-12,14H,1-2,5-8,13H2,(H,27,32)(H,33,34)