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

Systemtic Name: [5-bromanyl-2-(7-chloranyl-1,8-naphthyridin-2-yl)-3-oxidanylidene-1H-isoindol-1-yl] 4-methylpiperazine-1-carboxylate Openeye Name: [5-bromo-2-(7-chloro-1,8-naphthyridin-2-yl)-3-oxo-isoindolin-1-yl] 4-methylpiperazine-1-carboxylate CAS Name: 4-methyl-1-piperazinecarboxylic acid [5-bromo-2-(7-chloro-1,8-naphthyridin-2-yl)-3-oxo-1H-isoindol-1-yl] ester IUPAC Name: [5-bromo-2-(7-chloro-1,8-naphthyridin-2-yl)-3-oxo-1H-isoindol-1-yl] 4-methylpiperazine-1-carboxylate Traditional Name: 4-methylpiperazine-1-carboxylic acid [5-bromo-2-(7-chloro-1,8-naphthyridin-2-yl)-3-keto-isoindolin-1-yl] ester Formula: C22H19BrClN5O3 MolecularWeight: 516.77496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H19BrClN5O3/c1-27-8-10-28(11-9-27)22(31)32-21-15-5-4-14(23)12-16(15)20(30)29(21)18-7-3-13-2-6-17(24)25-19(13)26-18/h2-7,12,21H,8-11H2,1H3