N-[3-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]propyl]-N-(3-fluorophenyl)-3,4,5-trimethoxy-benzamide

Systemtic Name: N-[3-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]propyl]-N-(3-fluorophenyl)-3,4,5-trimethoxy-benzamide Openeye Name: N-[3-(1,3-dioxobenzo[de]isoquinolin-2-yl)propyl]-N-(3-fluorophenyl)-3,4,5-trimethoxy-benzamide CAS Name: N-[3-(1,3-dioxo-2-benzo[de]isoquinolinyl)propyl]-N-(3-fluorophenyl)-3,4,5-trimethoxybenzamide IUPAC Name: N-[3-(1,3-dioxobenzo[de]isoquinolin-2-yl)propyl]-N-(3-fluorophenyl)-3,4,5-trimethoxybenzamide Traditional Name: N-[3-(1,3-diketobenzo[de]isoquinolin-2-yl)propyl]-N-(3-fluorophenyl)-3,4,5-trimethoxy-benzamide Formula: C31H27FN2O6 MolecularWeight: 542.554283

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)N(CCCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)C5=CC(=CC=C5)F

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)N(CCCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)C5=CC(=CC=C5)F

InChI

InChI=1S/C31H27FN2O6/c1-38-25-16-20(17-26(39-2)28(25)40-3)29(35)33(22-11-6-10-21(32)18-22)14-7-15-34-30(36)23-12-4-8-19-9-5-13-24(27(19)23)31(34)37/h4-6,8-13,16-18H,7,14-15H2,1-3H3