2-[3-[2-chloranyl-4-(6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)phenoxy]propyl]isoindole-1,3-dione

Systemtic Name: 2-[3-[2-chloranyl-4-(6-oxidanylidene-4,5-dihydro-1H-pyridazin-3-yl)phenoxy]propyl]isoindole-1,3-dione Openeye Name: 2-[3-[2-chloro-4-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenoxy]propyl]isoindoline-1,3-dione CAS Name: 2-[3-[2-chloro-4-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenoxy]propyl]isoindole-1,3-dione IUPAC Name: 2-[3-[2-chloro-4-(6-oxo-4,5-dihydro-1H-pyridazin-3-yl)phenoxy]propyl]isoindole-1,3-dione Traditional Name: 2-[3-[2-chloro-4-(6-keto-4,5-dihydro-1H-pyridazin-3-yl)phenoxy]propyl]isoindoline-1,3-quinone Formula: C21H18ClN3O4 MolecularWeight: 411.83832

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)NN=C1C2=CC(=C(C=C2)OCCCN3C(=O)C4=CC=CC=C4C3=O)Cl

Isomeric SMILES

C1CC(=O)NN=C1C2=CC(=C(C=C2)OCCCN3C(=O)C4=CC=CC=C4C3=O)Cl

InChI

InChI=1S/C21H18ClN3O4/c22-16-12-13(17-7-9-19(26)24-23-17)6-8-18(16)29-11-3-10-25-20(27)14-4-1-2-5-15(14)21(25)28/h1-2,4-6,8,12H,3,7,9-11H2,(H,24,26)