4-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]-N-[(2,4,5-trimethoxyphenyl)methyl]butanamide

Systemtic Name: 4-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]-N-[(2,4,5-trimethoxyphenyl)methyl]butanamide Openeye Name: 4-(1,3-dioxobenzo[de]isoquinolin-2-yl)-N-[(2,4,5-trimethoxyphenyl)methyl]butanamide CAS Name: 4-(1,3-dioxo-2-benzo[de]isoquinolinyl)-N-[(2,4,5-trimethoxyphenyl)methyl]butanamide IUPAC Name: 4-(1,3-dioxobenzo[de]isoquinolin-2-yl)-N-[(2,4,5-trimethoxyphenyl)methyl]butanamide Traditional Name: 4-(1,3-diketobenzo[de]isoquinolin-2-yl)-N-(2,4,5-trimethoxybenzyl)butyramide Formula: C26H26N2O6 MolecularWeight: 462.49444

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CNC(=O)CCCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)OC)OC

Isomeric SMILES

COC1=CC(=C(C=C1CNC(=O)CCCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)OC)OC

InChI

InChI=1S/C26H26N2O6/c1-32-20-14-22(34-3)21(33-2)13-17(20)15-27-23(29)11-6-12-28-25(30)18-9-4-7-16-8-5-10-19(24(16)18)26(28)31/h4-5,7-10,13-14H,6,11-12,15H2,1-3H3,(H,27,29)