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

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

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C3C(=C1)C(=O)N(C(=O)C3=CC=C2)CCCC(=O)NC4=CN=CC=C4

Isomeric SMILES

C1=CC2=C3C(=C1)C(=O)N(C(=O)C3=CC=C2)CCCC(=O)NC4=CN=CC=C4

InChI

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