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

Systemtic Name: 4-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]-N-pyridin-2-yl-butanamide Openeye Name: 4-(1,3-dioxobenzo[de]isoquinolin-2-yl)-N-(2-pyridyl)butanamide CAS Name: 4-(1,3-dioxo-2-benzo[de]isoquinolinyl)-N-(2-pyridinyl)butanamide IUPAC Name: 4-(1,3-dioxobenzo[de]isoquinolin-2-yl)-N-pyridin-2-ylbutanamide Traditional Name: 4-(1,3-diketobenzo[de]isoquinolin-2-yl)-N-(2-pyridyl)butyramide Formula: C21H17N3O3 MolecularWeight: 359.37798

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)NC(=O)CCCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O

Isomeric SMILES

C1=CC=NC(=C1)NC(=O)CCCN2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O

InChI

InChI=1S/C21H17N3O3/c25-18(23-17-10-1-2-12-22-17)11-5-13-24-20(26)15-8-3-6-14-7-4-9-16(19(14)15)21(24)27/h1-4,6-10,12H,5,11,13H2,(H,22,23,25)