N'-(4-fluorophenyl)carbonyl-1,3-bis(oxidanylidene)-2-(oxolan-2-ylmethyl)isoindole-5-carbohydrazide

Systemtic Name: N'-(4-fluorophenyl)carbonyl-1,3-bis(oxidanylidene)-2-(oxolan-2-ylmethyl)isoindole-5-carbohydrazide Openeye Name: N'-(4-fluorobenzoyl)-1,3-dioxo-2-(tetrahydrofuran-2-ylmethyl)isoindoline-5-carbohydrazide CAS Name: N'-[(4-fluorophenyl)-oxomethyl]-1,3-dioxo-2-(2-oxolanylmethyl)-5-isoindolecarbohydrazide IUPAC Name: N'-(4-fluorobenzoyl)-1,3-dioxo-2-(oxolan-2-ylmethyl)isoindole-5-carbohydrazide Traditional Name: N'-(4-fluorobenzoyl)-1,3-diketo-2-(tetrahydrofurfuryl)isoindoline-5-carbohydrazide Formula: C21H18FN3O5 MolecularWeight: 411.383123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NNC(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1CC(OC1)CN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NNC(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C21H18FN3O5/c22-14-6-3-12(4-7-14)18(26)23-24-19(27)13-5-8-16-17(10-13)21(29)25(20(16)28)11-15-2-1-9-30-15/h3-8,10,15H,1-2,9,11H2,(H,23,26)(H,24,27)