[2-(7-chloranyl-1,8-naphthyridin-2-yl)-6-fluoranyl-3-oxidanylidene-1H-isoindol-1-yl] 4-methylpiperazine-1-carboxylate

Systemtic Name: [2-(7-chloranyl-1,8-naphthyridin-2-yl)-6-fluoranyl-3-oxidanylidene-1H-isoindol-1-yl] 4-methylpiperazine-1-carboxylate Openeye Name: [2-(7-chloro-1,8-naphthyridin-2-yl)-6-fluoro-3-oxo-isoindolin-1-yl] 4-methylpiperazine-1-carboxylate CAS Name: 4-methyl-1-piperazinecarboxylic acid [2-(7-chloro-1,8-naphthyridin-2-yl)-6-fluoro-3-oxo-1H-isoindol-1-yl] ester IUPAC Name: [2-(7-chloro-1,8-naphthyridin-2-yl)-6-fluoro-3-oxo-1H-isoindol-1-yl] 4-methylpiperazine-1-carboxylate Traditional Name: 4-methylpiperazine-1-carboxylic acid [2-(7-chloro-1,8-naphthyridin-2-yl)-6-fluoro-3-keto-isoindolin-1-yl] ester Formula: C22H19ClFN5O3 MolecularWeight: 455.869363

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)OC2C3=C(C=CC(=C3)F)C(=O)N2C4=NC5=C(C=C4)C=CC(=N5)Cl

Isomeric SMILES

CN1CCN(CC1)C(=O)OC2C3=C(C=CC(=C3)F)C(=O)N2C4=NC5=C(C=C4)C=CC(=N5)Cl

InChI

InChI=1S/C22H19ClFN5O3/c1-27-8-10-28(11-9-27)22(31)32-21-16-12-14(24)4-5-15(16)20(30)29(21)18-7-3-13-2-6-17(23)25-19(13)26-18/h2-7,12,21H,8-11H2,1H3