[2-(7-chloranyl-1,8-naphthyridin-2-yl)-3-oxidanylidene-1H-isoindol-1-yl] 4-(phenylcarbonyl)piperazine-1-carboxylate

Systemtic Name: [2-(7-chloranyl-1,8-naphthyridin-2-yl)-3-oxidanylidene-1H-isoindol-1-yl] 4-(phenylcarbonyl)piperazine-1-carboxylate Openeye Name: [2-(7-chloro-1,8-naphthyridin-2-yl)-3-oxo-isoindolin-1-yl] 4-benzoylpiperazine-1-carboxylate CAS Name: 4-benzoyl-1-piperazinecarboxylic acid [2-(7-chloro-1,8-naphthyridin-2-yl)-3-oxo-1H-isoindol-1-yl] ester IUPAC Name: [2-(7-chloro-1,8-naphthyridin-2-yl)-3-oxo-1H-isoindol-1-yl] 4-benzoylpiperazine-1-carboxylate Traditional Name: 4-benzoylpiperazine-1-carboxylic acid [2-(7-chloro-1,8-naphthyridin-2-yl)-3-keto-isoindolin-1-yl] ester Formula: C28H22ClN5O4 MolecularWeight: 527.95838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=CC=C2)C(=O)OC3C4=CC=CC=C4C(=O)N3C5=NC6=C(C=C5)C=CC(=N6)Cl

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=CC=C2)C(=O)OC3C4=CC=CC=C4C(=O)N3C5=NC6=C(C=C5)C=CC(=N6)Cl

InChI

InChI=1S/C28H22ClN5O4/c29-22-12-10-18-11-13-23(31-24(18)30-22)34-26(36)20-8-4-5-9-21(20)27(34)38-28(37)33-16-14-32(15-17-33)25(35)19-6-2-1-3-7-19/h1-13,27H,14-17H2