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

Systemtic Name: [2-(5-chloranyl-1,8-naphthyridin-2-yl)-3-oxidanylidene-1H-isoindol-1-yl] 4-methylpiperazine-1-carboxylate Openeye Name: [2-(5-chloro-1,8-naphthyridin-2-yl)-3-oxo-isoindolin-1-yl] 4-methylpiperazine-1-carboxylate CAS Name: 4-methyl-1-piperazinecarboxylic acid [2-(5-chloro-1,8-naphthyridin-2-yl)-3-oxo-1H-isoindol-1-yl] ester IUPAC Name: [2-(5-chloro-1,8-naphthyridin-2-yl)-3-oxo-1H-isoindol-1-yl] 4-methylpiperazine-1-carboxylate Traditional Name: 4-methylpiperazine-1-carboxylic acid [2-(5-chloro-1,8-naphthyridin-2-yl)-3-keto-isoindolin-1-yl] ester Formula: C22H20ClN5O3 MolecularWeight: 437.8789

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)OC2C3=CC=CC=C3C(=O)N2C4=NC5=NC=CC(=C5C=C4)Cl

Isomeric SMILES

CN1CCN(CC1)C(=O)OC2C3=CC=CC=C3C(=O)N2C4=NC5=NC=CC(=C5C=C4)Cl

InChI

InChI=1S/C22H20ClN5O3/c1-26-10-12-27(13-11-26)22(30)31-21-15-5-3-2-4-14(15)20(29)28(21)18-7-6-16-17(23)8-9-24-19(16)25-18/h2-9,21H,10-13H2,1H3