[2-(7-chloranyl-1,8-naphthyridin-2-yl)-5-nitro-3-oxidanylidene-1H-isoindol-1-yl] 4-methylpiperazine-1-carboxylate

Systemtic Name: [2-(7-chloranyl-1,8-naphthyridin-2-yl)-5-nitro-3-oxidanylidene-1H-isoindol-1-yl] 4-methylpiperazine-1-carboxylate Openeye Name: [2-(7-chloro-1,8-naphthyridin-2-yl)-5-nitro-3-oxo-isoindolin-1-yl] 4-methylpiperazine-1-carboxylate CAS Name: 4-methyl-1-piperazinecarboxylic acid [2-(7-chloro-1,8-naphthyridin-2-yl)-5-nitro-3-oxo-1H-isoindol-1-yl] ester IUPAC Name: [2-(7-chloro-1,8-naphthyridin-2-yl)-5-nitro-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)-3-keto-5-nitro-isoindolin-1-yl] ester Formula: C22H19ClN6O5 MolecularWeight: 482.87646

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)OC2C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)N2C4=NC5=C(C=C4)C=CC(=N5)Cl

Isomeric SMILES

CN1CCN(CC1)C(=O)OC2C3=C(C=C(C=C3)[N+](=O)[O-])C(=O)N2C4=NC5=C(C=C4)C=CC(=N5)Cl

InChI

InChI=1S/C22H19ClN6O5/c1-26-8-10-27(11-9-26)22(31)34-21-15-5-4-14(29(32)33)12-16(15)20(30)28(21)18-7-3-13-2-6-17(23)24-19(13)25-18/h2-7,12,21H,8-11H2,1H3