1-cyclopropyl-6-fluoranyl-7-[4-[(2E)-2-methoxyimino-2-(2-oxidanylidenechromen-3-yl)ethyl]piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-cyclopropyl-6-fluoranyl-7-[4-[(2E)-2-methoxyimino-2-(2-oxidanylidenechromen-3-yl)ethyl]piperazin-1-yl]-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-cyclopropyl-6-fluoro-7-[4-[(2E)-2-methoxyimino-2-(2-oxochromen-3-yl)ethyl]piperazin-1-yl]-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-cyclopropyl-6-fluoro-7-[4-[(2E)-2-methoxyimino-2-(2-oxo-1-benzopyran-3-yl)ethyl]-1-piperazinyl]-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-cyclopropyl-6-fluoro-7-[4-[(2E)-2-methoxyimino-2-(2-oxochromen-3-yl)ethyl]piperazin-1-yl]-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-cyclopropyl-6-fluoro-4-keto-7-[4-[(2E)-2-(2-ketochromen-3-yl)-2-methyloximino-ethyl]piperazino]quinoline-3-carboxylic acid Formula: C29H27FN4O6 MolecularWeight: 546.546283

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Descriptors Computed from Structure

Canonical SMILES:

CON=C(CN1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F)C5=CC6=CC=CC=C6OC5=O

Isomeric SMILES

CO/N=C(/CN1CCN(CC1)C2=C(C=C3C(=C2)N(C=C(C3=O)C(=O)O)C4CC4)F)\C5=CC6=CC=CC=C6OC5=O

InChI

InChI=1S/C29H27FN4O6/c1-39-31-23(19-12-17-4-2-3-5-26(17)40-29(19)38)16-32-8-10-33(11-9-32)25-14-24-20(13-22(25)30)27(35)21(28(36)37)15-34(24)18-6-7-18/h2-5,12-15,18H,6-11,16H2,1H3,(H,36,37)/b31-23-