2-(3-butanoyl-4-chloranyl-quinolin-6-yl)isoindole-1,3-dione

Systemtic Name: 2-(3-butanoyl-4-chloranyl-quinolin-6-yl)isoindole-1,3-dione Openeye Name: 2-(3-butanoyl-4-chloro-6-quinolyl)isoindoline-1,3-dione CAS Name: 2-[4-chloro-3-(1-oxobutyl)-6-quinolinyl]isoindole-1,3-dione IUPAC Name: 2-(3-butanoyl-4-chloroquinolin-6-yl)isoindole-1,3-dione Traditional Name: 2-(3-butyryl-4-chloro-6-quinolyl)isoindoline-1,3-quinone Formula: C21H15ClN2O3 MolecularWeight: 378.8084

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=CN=C2C=CC(=CC2=C1Cl)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CCCC(=O)C1=CN=C2C=CC(=CC2=C1Cl)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C21H15ClN2O3/c1-2-5-18(25)16-11-23-17-9-8-12(10-15(17)19(16)22)24-20(26)13-6-3-4-7-14(13)21(24)27/h3-4,6-11H,2,5H2,1H3