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

Systemtic Name: 4-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]-N-(4-phenoxyphenyl)butanamide Openeye Name: 4-(1,3-dioxobenzo[de]isoquinolin-2-yl)-N-(4-phenoxyphenyl)butanamide CAS Name: 4-(1,3-dioxo-2-benzo[de]isoquinolinyl)-N-(4-phenoxyphenyl)butanamide IUPAC Name: 4-(1,3-dioxobenzo[de]isoquinolin-2-yl)-N-(4-phenoxyphenyl)butanamide Traditional Name: 4-(1,3-diketobenzo[de]isoquinolin-2-yl)-N-(4-phenoxyphenyl)butyramide Formula: C28H22N2O4 MolecularWeight: 450.48528

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CCCN3C(=O)C4=CC=CC5=C4C(=CC=C5)C3=O

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)NC(=O)CCCN3C(=O)C4=CC=CC5=C4C(=CC=C5)C3=O

InChI

InChI=1S/C28H22N2O4/c31-25(29-20-14-16-22(17-15-20)34-21-9-2-1-3-10-21)13-6-18-30-27(32)23-11-4-7-19-8-5-12-24(26(19)23)28(30)33/h1-5,7-12,14-17H,6,13,18H2,(H,29,31)