1-cyclopropyl-6,7-bis(fluoranyl)-8-methoxy-3-(4-pyridin-1-ium-2-ylpiperazin-1-yl)carbonyl-quinolin-4-one

Systemtic Name: 1-cyclopropyl-6,7-bis(fluoranyl)-8-methoxy-3-(4-pyridin-1-ium-2-ylpiperazin-1-yl)carbonyl-quinolin-4-one Openeye Name: 1-cyclopropyl-6,7-difluoro-8-methoxy-3-(4-pyridin-1-ium-2-ylpiperazine-1-carbonyl)quinolin-4-one CAS Name: 1-cyclopropyl-6,7-difluoro-8-methoxy-3-[oxo-[4-(2-pyridin-1-iumyl)-1-piperazinyl]methyl]-4-quinolinone IUPAC Name: 1-cyclopropyl-6,7-difluoro-8-methoxy-3-(4-pyridin-1-ium-2-ylpiperazine-1-carbonyl)quinolin-4-one Traditional Name: 1-cyclopropyl-6,7-difluoro-8-methoxy-3-(4-pyridin-1-ium-2-ylpiperazine-1-carbonyl)-4-quinolone Formula: C23H23F2N4O3+ MolecularWeight: 441.450526

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1F)F)C(=O)C(=CN2C3CC3)C(=O)N4CCN(CC4)C5=CC=CC=[NH+]5

Isomeric SMILES

COC1=C2C(=CC(=C1F)F)C(=O)C(=CN2C3CC3)C(=O)N4CCN(CC4)C5=CC=CC=[NH+]5

InChI

InChI=1S/C23H22F2N4O3/c1-32-22-19(25)17(24)12-15-20(22)29(14-5-6-14)13-16(21(15)30)23(31)28-10-8-27(9-11-28)18-4-2-3-7-26-18/h2-4,7,12-14H,5-6,8-11H2,1H3/p+1